SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'HEC'


List of Similar Pattern of Amino Acids

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID		 Hit
Macromolecule		 Res.
Matches		 Interface HETATM RMSD Dali
Z-score		 Seq.
Identity (%)		 View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1A8U_A_BEZA295_0
(CHLOROPEROXIDASE T)		 1m6z CYTOCHROME C4
(Pseudomonas
stutzeri) 		5 / 10 GLY A 103
PHE A 107
LEU A 174
THR A 146
LEU A 150
 None
None
None
HEC  A 200 ( 4.2A)
HEC  A 200 (-4.8A)
 1.03A 1a8uA-1m6zA:
undetectable		 1a8uA-1m6zA:
23.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1AXW_A_MTXA732_1
(THYMIDYLATE SYNTHASE)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		5 / 12 HIS A 164
ILE A 205
LEU A 143
LEU A 155
GLY A 152
 HEC  A1002 (-3.2A)
HEC  A1002 (-4.0A)
None
None
None
 1.04A 1axwA-4wqeA:
undetectable		 1axwA-4wqeA:
22.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DHF_B_FOLB187_0
(DIHYDROFOLATE
REDUCTASE)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 12 ILE A 377
ALA A 537
THR A 337
ILE A 335
LEU A 374
 HEC  A 807 ( 4.4A)
None
None
None
None
 1.12A 1dhfB-4lm8A:
undetectable		 1dhfB-4lm8A:
13.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1DMI_A_BHSA1610_1
(NITRIC OXIDE
SYNTHASE)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		4 / 8 VAL A 129
ALA A 179
PHE A 109
GLU A 112
 HEC  A1004 (-3.9A)
HEC  A1004 ( 4.9A)
SO3  A 526 (-4.6A)
None
 1.13A 1dmiA-3ttbA:
undetectable
1dmiB-3ttbA:
undetectable		 1dmiA-3ttbA:
21.88
1dmiB-3ttbA:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1E71_M_ASCM995_0
(MYROSINASE MA1)		 3vrd FLAVOCYTOCHROME C
HEME SUBUNIT
(Thermochromatium
tepidum) 		4 / 7 GLN A  43
ILE A  49
ARG A 141
PHE A 136
 HEC  A 202 ( 4.6A)
None
HEC  A 202 ( 3.0A)
HEC  A 202 (-4.5A)
 1.20A 1e71M-3vrdA:
undetectable		 1e71M-3vrdA:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1E72_M_ASCM995_0
(MYROSINASE MA1)		 3vrd FLAVOCYTOCHROME C
HEME SUBUNIT
(Thermochromatium
tepidum) 		4 / 7 GLN A  43
ILE A  49
ARG A 141
PHE A 136
 HEC  A 202 ( 4.6A)
None
HEC  A 202 ( 3.0A)
HEC  A 202 (-4.5A)
 1.17A 1e72M-3vrdA:
undetectable		 1e72M-3vrdA:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1E73_M_ASCM995_0
(MYROSINASE MA1)		 3vrd FLAVOCYTOCHROME C
HEME SUBUNIT
(Thermochromatium
tepidum) 		4 / 6 GLN A  43
ILE A  49
ARG A 141
PHE A 136
 HEC  A 202 ( 4.6A)
None
HEC  A 202 ( 3.0A)
HEC  A 202 (-4.5A)
 1.21A 1e73M-3vrdA:
undetectable		 1e73M-3vrdA:
16.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1E7A_A_PFLA4001_1
(SERUM ALBUMIN)		 1k3g CYTOCHROME C-553
(Sporosarcina
pasteurii) 		5 / 9 LEU A  61
ILE A  64
VAL A  27
CYH A  32
ALA A  76
 None
HEC  A  93 (-3.6A)
None
HEC  A  93 (-1.8A)
HEC  A  93 ( 3.6A)
 1.00A 1e7aA-1k3gA:
undetectable		 1e7aA-1k3gA:
8.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EKJ_F_ACTF3008_0
(BETA-CARBONIC
ANHYDRASE)		 1c2n CYTOCHROME C2
(Rhodobacter
capsulatus) 		4 / 8 PHE A  98
CYH A  13
GLY A 104
GLY A 103
 HEC  A 117 (-2.7A)
HEC  A 117 (-1.8A)
None
None
 0.85A 1ekjE-1c2nA:
undetectable
1ekjF-1c2nA:
undetectable		 1ekjE-1c2nA:
23.53
1ekjF-1c2nA:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EKJ_F_ACTF3008_0
(BETA-CARBONIC
ANHYDRASE)		 1c2n CYTOCHROME C2
(Rhodobacter
capsulatus) 		4 / 8 PHE A  98
VAL A  76
GLY A 103
GLY A 104
 HEC  A 117 (-2.7A)
HEC  A 117 (-4.9A)
None
None
 0.89A 1ekjE-1c2nA:
undetectable
1ekjF-1c2nA:
undetectable		 1ekjE-1c2nA:
23.53
1ekjF-1c2nA:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1EPB_A_9CRA165_1
(EPIDIDYMAL RETINOIC
ACID-BINDING PROTEIN)		 1k3g CYTOCHROME C-553
(Sporosarcina
pasteurii) 		5 / 12 ILE A  33
MET A  71
VAL A  84
ALA A  76
ILE A  64
 None
HEC  A  93 (-2.4A)
HEC  A  93 (-4.2A)
HEC  A  93 ( 3.6A)
HEC  A  93 (-3.6A)
 0.96A 1epbA-1k3gA:
undetectable		 1epbA-1k3gA:
17.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ETA_1_T441128_1
(TRANSTHYRETIN)		 1zzh CYTOCHROME C
PEROXIDASE
(Rhodobacter
capsulatus) 		4 / 5 LEU A 166
GLU A 160
ALA A  89
LEU A  87
 None
None
HEC  A 802 ( 3.9A)
None
 1.12A 1eta1-1zzhA:
undetectable		 1eta1-1zzhA:
19.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ETA_2_T442129_1
(TRANSTHYRETIN)		 1zzh CYTOCHROME C
PEROXIDASE
(Rhodobacter
capsulatus) 		4 / 5 LEU A 166
GLU A 160
ALA A  89
LEU A  87
 None
None
HEC  A 802 ( 3.9A)
None
 1.18A 1eta2-1zzhA:
undetectable		 1eta2-1zzhA:
19.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ETB_1_T441128_1
(TRANSTHYRETIN)		 1zzh CYTOCHROME C
PEROXIDASE
(Rhodobacter
capsulatus) 		4 / 6 LEU A 166
GLU A 160
ALA A  89
LEU A  87
 None
None
HEC  A 802 ( 3.9A)
None
 1.15A 1etb1-1zzhA:
undetectable		 1etb1-1zzhA:
20.19
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1FDU_C_ESTC353_1
(17-BETA-HYDROXYSTERO
ID DEHYDROGENASE)		 1tu2 APOCYTOCHROME F
(Nostoc
sp.
PCC
7119) 		5 / 12 VAL B  72
GLY B  73
GLY B 121
PRO B 120
TYR B 102
 HEC  B 255 (-4.0A)
HEC  B 255 (-2.8A)
None
None
None
 1.20A 1fduC-1tu2B:
undetectable		 1fduC-1tu2B:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1G50_A_ESTA600_1
(ESTROGEN RECEPTOR)		 2c1d SOXX
(Paracoccus
pantotrophus) 		5 / 11 LEU B 152
GLU B  92
ARG B  96
MET B  53
ILE B  52
 HEC  B1158 ( 4.9A)
None
None
None
None
 1.27A 1g50A-2c1dB:
undetectable		 1g50A-2c1dB:
21.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTI_F_CCSF47_0
(GLUTATHIONE
S-TRANSFERASE)		 4y5r METHYLAMINE
UTILIZATION PROTEIN
MAUG
(Paracoccus
denitrificans) 		4 / 5 LEU A 249
GLY A 248
LYS A 265
TYR A 223
 None
None
HEC  A 402 (-3.3A)
None
 1.39A 1gtiF-4y5rA:
undetectable		 1gtiF-4y5rA:
22.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1GTN_A_TRPA81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 3vrd FLAVOCYTOCHROME C
HEME SUBUNIT
FLAVOCYTOCHROME C
FLAVIN SUBUNIT
(Thermochromatium
tepidum;
Thermochromatium
tepidum) 		4 / 7 GLY A  55
ALA B 350
ILE A  57
SER B 348
 None
None
HEC  A 201 ( 4.4A)
None
 0.76A 1gtnA-3vrdA:
undetectable
1gtnK-3vrdA:
undetectable		 1gtnA-3vrdA:
19.33
1gtnK-3vrdA:
19.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HZE_A_RBFA98_1
(RIBOFLAVIN SYNTHASE
ALPHA CHAIN)		 1k3g CYTOCHROME C-553
(Sporosarcina
pasteurii) 		5 / 9 LEU A  61
ASP A  62
LEU A  65
ILE A  75
ILE A  48
 None
None
None
HEC  A  93 (-3.5A)
HEC  A  93 (-3.8A)
 1.46A 1hzeA-1k3gA:
undetectable
1hzeB-1k3gA:
undetectable		 1hzeA-1k3gA:
21.21
1hzeB-1k3gA:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1HZE_B_RBFB99_1
(RIBOFLAVIN SYNTHASE
ALPHA CHAIN)		 1k3g CYTOCHROME C-553
(Sporosarcina
pasteurii) 		5 / 9 ILE A  48
LEU A  61
ASP A  62
LEU A  65
ILE A  75
 HEC  A  93 (-3.8A)
None
None
None
HEC  A  93 (-3.5A)
 1.46A 1hzeA-1k3gA:
undetectable
1hzeB-1k3gA:
undetectable		 1hzeA-1k3gA:
21.21
1hzeB-1k3gA:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1J8U_A_H4BA429_1
(PHENYLALANINE-4-HYDR
OXYLASE)		 4aal CYTOCHROME C551
PEROXIDASE
(Geobacter
sulfurreducens) 		4 / 7 VAL A 294
PHE A 214
LEU A 215
ALA A  29
 HEC  A 424 ( 4.1A)
HEC  A 424 ( 4.9A)
None
None
 0.78A 1j8uA-4aalA:
undetectable		 1j8uA-4aalA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1L7F_A_BCZA801_0
(NEURAMINIDASE)		 1jmz AMINE DEHYDROGENASE
AMINE DEHYDROGENASE
(Pseudomonas
putida;
Pseudomonas
putida) 		5 / 12 GLU A 134
ARG B 148
ILE A 147
ARG A 142
ARG A 102
 None
None
None
None
HEC  A1001 ( 3.9A)
 1.47A 1l7fA-1jmzA:
undetectable		 1l7fA-1jmzA:
19.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1L7X_A_CFFA864_1
(GLYCOGEN
PHOSPHORYLASE, LIVER
FORM)		 1jmz AMINE DEHYDROGENASE
(Pseudomonas
putida) 		3 / 3 TRP A 130
HIS A 104
LYS G  44
 HEC  A1001 (-4.1A)
HEC  A1001 (-3.2A)
TRQ  G  43 (-3.0A)
 1.26A 1l7xA-1jmzA:
0.0		 1l7xA-1jmzA:
21.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1LWE_A_NVPA999_1
(HIV-1 REVERSE
TRANSCRIPTASE)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		4 / 7 VAL A 311
TYR A 296
TYR A 308
GLY A 280
 HEC  A 801 ( 4.0A)
None
HEC  A 801 ( 4.6A)
None
 0.95A 1lweA-4lmhA:
undetectable		 1lweA-4lmhA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1M2Z_D_DEXD401_1
(GLUCOCORTICOID
RECEPTOR)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 12 GLY A 514
MET A 517
CYH A 538
THR A 540
ILE A 377
 None
HEC  A 807 ( 3.8A)
HEC  A 807 (-1.7A)
HEC  A 807 (-4.7A)
HEC  A 807 ( 4.4A)
 1.41A 1m2zD-4lm8A:
undetectable		 1m2zD-4lm8A:
16.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1M8E_B_H4BB903_1
(INDUCIBLE NITRIC
OXIDE SYNTHASE)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		3 / 3 ARG A  67
ILE A 107
TRP A 136
 HEC  A 802 (-4.2A)
None
None
 1.04A 1m8eB-1kb0A:
0.0		 1m8eB-1kb0A:
19.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MEH_A_MOAA600_1
(INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE)		 6f0k CYTOCHROME C FAMILY
PROTEIN
FE-S-CLUSTER-CONTAIN
ING HYDROGENASE
(Rhodothermus
marinus) 		5 / 10 SER A 127
ASN A 131
ILE A 200
GLY A 199
GLU B 963
 HEC  A 302 (-2.5A)
HEC  A 302 (-2.7A)
HEC  A 302 (-3.4A)
None
None
 1.29A 1mehA-6f0kA:
undetectable		 1mehA-6f0kA:
9.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MJO_B_SAMB200_0
(METHIONINE REPRESSOR)		 2xts CYTOCHROME
(Paracoccus
pantotrophus) 		4 / 4 HIS B  74
ALA B  78
PHE B  77
GLY B  80
 HEC  B 500 (-3.2A)
None
None
None
 1.26A 1mjoA-2xtsB:
undetectable		 1mjoA-2xtsB:
20.98
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N4H_A_REAA500_1
(NUCLEAR RECEPTOR
ROR-BETA)		 5c2v HYDRAZINE SYNTHASE
ALPHA SUBUNIT
(Candidatus
Kuenenia
stuttgartiensis) 		5 / 11 CYH A 583
ILE A 459
ALA A 603
VAL A 489
LEU A 575
 HEC  A 905 (-1.8A)
None
None
None
None
 1.19A 1n4hA-5c2vA:
undetectable		 1n4hA-5c2vA:
16.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1N6C_A_SAMA402_0
(SET
DOMAIN-CONTAINING
PROTEIN 7)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		5 / 11 ILE A 159
ALA A 155
GLY A 154
ASN A 226
HIS A 126
 None
None
None
None
HEC  A1004 (-4.4A)
 1.25A 1n6cA-3ttbA:
undetectable		 1n6cA-3ttbA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NBI_A_SAMA293_1
(GLYCINE
N-METHYLTRANSFERASE)		 5mvo FOXE
(Rhodobacter
sp.
SW2) 		4 / 5 ARG A  93
ASP A 228
MET A 230
ASN A 123
 HEC  A 301 (-3.8A)
None
HEC  A 301 (-2.2A)
None
 1.43A 1nbiA-5mvoA:
undetectable		 1nbiA-5mvoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NBI_B_SAMB1293_1
(GLYCINE
N-METHYLTRANSFERASE)		 5mvo FOXE
(Rhodobacter
sp.
SW2) 		4 / 5 ARG A  93
ASP A 228
MET A 230
ASN A 123
 HEC  A 301 (-3.8A)
None
HEC  A 301 (-2.2A)
None
 1.43A 1nbiB-5mvoA:
undetectable		 1nbiB-5mvoA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NG8_A_DVAA8_0
(GRAMICIDIN A)		 2c1u DI-HAEM CYTOCHROME C
PEROXIDASE
(Paracoccus
pantotrophus) 		4 / 4 GLY A 121
VAL A 123
TRP A  87
GLY A 126
 None
HEC  A 401 (-4.6A)
None
None
 1.35A 1ng8A-2c1uA:
undetectable		 1ng8A-2c1uA:
5.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NG8_B_DVAB8_0
(GRAMICIDIN A)		 2c1u DI-HAEM CYTOCHROME C
PEROXIDASE
(Paracoccus
pantotrophus) 		4 / 4 GLY A 121
VAL A 123
TRP A  87
GLY A 126
 None
HEC  A 401 (-4.6A)
None
None
 1.35A 1ng8B-2c1uA:
undetectable		 1ng8B-2c1uA:
5.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1NOD_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		3 / 3 ARG A  67
ILE A 107
TRP A 136
 HEC  A 802 (-4.2A)
None
None
 1.09A 1nodB-1kb0A:
0.0		 1nodB-1kb0A:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ONI_A_BEZA502_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 1zzh CYTOCHROME C
PEROXIDASE
(Rhodobacter
capsulatus) 		4 / 6 ASN A  92
ASN A 212
ILE A 207
GLY A 206
 HEC  A 802 (-3.9A)
None
None
None
 1.10A 1oniA-1zzhA:
undetectable
1oniB-1zzhA:
undetectable		 1oniA-1zzhA:
17.99
1oniB-1zzhA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ONI_D_BEZD508_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 1zzh CYTOCHROME C
PEROXIDASE
(Rhodobacter
capsulatus) 		4 / 6 ASN A  92
ASN A 212
ILE A 207
GLY A 206
 HEC  A 802 (-3.9A)
None
None
None
 1.07A 1oniD-1zzhA:
undetectable
1oniF-1zzhA:
undetectable		 1oniD-1zzhA:
17.99
1oniF-1zzhA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P6K_A_MTLA870_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE
POLYSULPHIDE
REDUCTASE NRFD
QUINOL:CYTOCHROME C
OXIDOREDUCTASE
MONOHEME CYTOCHROME
SUBUNIT
(Rhodothermus
marinus;
Rhodothermus
marinus;
Rhodothermus
marinus) 		4 / 8 ARG C 142
PHE B 939
ASN E  37
ASP E  41
 None
None
HEC  A 301 (-2.9A)
None
 1.15A 1p6kA-6f0kC:
0.3		 1p6kA-6f0kC:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P6K_B_MTLB871_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE
POLYSULPHIDE
REDUCTASE NRFD
QUINOL:CYTOCHROME C
OXIDOREDUCTASE
MONOHEME CYTOCHROME
SUBUNIT
(Rhodothermus
marinus;
Rhodothermus
marinus;
Rhodothermus
marinus) 		4 / 8 ARG C 142
PHE B 939
ASN E  37
ASP E  41
 None
None
HEC  A 301 (-2.9A)
None
 1.14A 1p6kB-6f0kC:
undetectable		 1p6kB-6f0kC:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1P93_A_DEXA1999_1
(GLUCOCORTICOID
RECEPTOR)		 1tu2 APOCYTOCHROME F
(Nostoc
sp.
PCC
7119) 		5 / 12 ASN B 154
GLY B 241
GLN B 242
ARG B  19
GLN B 159
 HEC  B 255 (-3.9A)
None
None
None
None
 1.36A 1p93A-1tu2B:
undetectable		 1p93A-1tu2B:
20.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1PNL_B_PACB559_0
(PENICILLIN
AMIDOHYDROLASE)		 1zrt CYTOCHROME C1
(Rhodobacter
capsulatus) 		4 / 8 PHE D  11
SER D 210
ALA D 104
ILE D 131
 None
None
None
HEC  D 501 ( 4.9A)
 1.17A 1pnlA-1zrtD:
undetectable
1pnlB-1zrtD:
1.4		 1pnlA-1zrtD:
21.85
1pnlB-1zrtD:
19.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Q13_A_TESA501_1
(PROSTAGLANDIN-E2
9-REDUCTASE)		 5lo9 CYTOCHROME C
(Marichromatium
purpuratum) 		4 / 6 TYR A 398
TYR A 469
HIS A 473
PRO A 422
 None
None
None
HEC  A1004 (-4.0A)
 1.36A 1q13A-5lo9A:
undetectable		 1q13A-5lo9A:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Q6I_A_FK5A301_1
(FKBP-TYPE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKPA)		 6f0k ACTH
QUINOL:CYTOCHROME C
OXIDOREDUCTASE
MONOHEME CYTOCHROME
SUBUNIT
(Rhodothermus
marinus) 		5 / 9 TYR H 159
LEU E 102
ILE E 172
TYR E 113
ILE E 112
 None
None
None
HEC  E 400 ( 4.6A)
None
 1.37A 1q6iA-6f0kH:
undetectable		 1q6iA-6f0kH:
15.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Q6I_B_FK5B401_1
(FKBP-TYPE
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKPA)		 6f0k ACTH
QUINOL:CYTOCHROME C
OXIDOREDUCTASE
MONOHEME CYTOCHROME
SUBUNIT
(Rhodothermus
marinus) 		5 / 10 TYR H 159
LEU E 102
ILE E 172
TYR E 113
ILE E 112
 None
None
None
HEC  E 400 ( 4.6A)
None
 1.41A 1q6iB-6f0kH:
undetectable		 1q6iB-6f0kH:
15.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QKN_A_RALA600_2
(ESTROGEN RECEPTOR
BETA)		 1zzh CYTOCHROME C
PEROXIDASE
(Rhodobacter
capsulatus) 		3 / 3 ASP A 174
LEU A 177
HIS A 204
 None
None
HEC  A 803 (-3.3A)
 0.69A 1qknA-1zzhA:
undetectable		 1qknA-1zzhA:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QKN_A_RALA600_2
(ESTROGEN RECEPTOR
BETA)		 2c1u DI-HAEM CYTOCHROME C
PEROXIDASE
(Paracoccus
pantotrophus) 		3 / 3 ASP A 185
LEU A 188
HIS A 215
 None
None
HEC  A 402 (-3.2A)
 0.62A 1qknA-2c1uA:
undetectable		 1qknA-2c1uA:
20.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1QOM_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		3 / 3 ARG A  67
ILE A 107
TRP A 136
 HEC  A 802 (-4.2A)
None
None
 1.17A 1qomA-1kb0A:
undetectable		 1qomA-1kb0A:
19.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RS6_A_MTLA870_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE
POLYSULPHIDE
REDUCTASE NRFD
QUINOL:CYTOCHROME C
OXIDOREDUCTASE
MONOHEME CYTOCHROME
SUBUNIT
(Rhodothermus
marinus;
Rhodothermus
marinus;
Rhodothermus
marinus) 		4 / 8 ARG C 142
PHE B 939
ASN E  37
ASP E  41
 None
None
HEC  A 301 (-2.9A)
None
 1.15A 1rs6A-6f0kC:
undetectable		 1rs6A-6f0kC:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1RS6_B_MTLB871_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE
POLYSULPHIDE
REDUCTASE NRFD
QUINOL:CYTOCHROME C
OXIDOREDUCTASE
MONOHEME CYTOCHROME
SUBUNIT
(Rhodothermus
marinus;
Rhodothermus
marinus;
Rhodothermus
marinus) 		4 / 8 ARG C 142
PHE B 939
ASN E  37
ASP E  41
 None
None
HEC  A 301 (-2.9A)
None
 1.15A 1rs6B-6f0kC:
undetectable		 1rs6B-6f0kC:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1S19_A_MC9A500_0
(VITAMIN D3 RECEPTOR)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT E
(Flavobacterium
johnsoniae) 		5 / 12 LEU E 181
LEU E 175
VAL E 174
ILE E 144
SER E 143
 None
None
None
HEC  E 201 ( 4.7A)
HEC  E 201 ( 4.6A)
 1.14A 1s19A-6btmE:
undetectable		 1s19A-6btmE:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1SQF_A_SAMA430_0
(SUN PROTEIN)		 2xts CYTOCHROME
(Paracoccus
pantotrophus) 		6 / 12 ALA B  71
GLY B  75
GLY B  80
ASP B  68
ASP B 133
PRO B 122
 None
None
None
None
None
HEC  B 500 (-3.7A)
 1.27A 1sqfA-2xtsB:
undetectable		 1sqfA-2xtsB:
18.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1T03_P_TFOP822_1
(POL POLYPROTEIN
SYNTHETIC
OLIGONUCLEOTIDE
PRIMER)		 4fas HYDROXYLAMINE
OXIDOREDUCTASE
NE1300
(Nitrosomonas
europaea) 		4 / 7 MET A 376
ASP A 377
ASP A 374
LYS D  23
 HEC  A 606 (-3.9A)
None
EDO  A 618 ( 4.1A)
None
 1.30A 1t03A-4fasA:
undetectable		 1t03A-4fasA:
23.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TLS_A_C2FA266_0
(THYMIDYLATE SYNTHASE)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		5 / 12 HIS A 164
ILE A 205
LEU A 143
LEU A 155
GLY A 152
 HEC  A1002 (-3.2A)
HEC  A1002 (-4.0A)
None
None
None
 1.07A 1tlsA-4wqeA:
undetectable		 1tlsA-4wqeA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TLS_B_C2FB266_0
(THYMIDYLATE SYNTHASE)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		5 / 12 HIS A 164
ILE A 205
LEU A 143
LEU A 155
GLY A 152
 HEC  A1002 (-3.2A)
HEC  A1002 (-4.0A)
None
None
None
 1.05A 1tlsB-4wqeA:
undetectable		 1tlsB-4wqeA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TSN_A_C2FA266_0
(THYMIDYLATE SYNTHASE)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		5 / 12 HIS A 164
ILE A 205
LEU A 143
LEU A 155
GLY A 152
 HEC  A1002 (-3.2A)
HEC  A1002 (-4.0A)
None
None
None
 1.01A 1tsnA-4wqeA:
undetectable		 1tsnA-4wqeA:
21.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TT0_A_ACTA4901_0
(PYRANOSE OXIDASE)		 4fas HYDROXYLAMINE
OXIDOREDUCTASE
(Nitrosomonas
europaea) 		4 / 6 THR A 214
PHE A 424
HIS A 233
ASN A 211
 PEG  A 614 (-4.0A)
PEG  A 614 ( 3.6A)
HEC  A 605 ( 3.4A)
None
 1.29A 1tt0A-4fasA:
undetectable		 1tt0A-4fasA:
21.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TT6_B_DESB128_1
(TRANSTHYRETIN)		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		4 / 5 LEU A  18
ALA A  16
LEU A  51
SER A  52
 None
HEC  A 201 (-3.4A)
None
None
 1.14A 1tt6B-5jt4A:
undetectable		 1tt6B-5jt4A:
23.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TV8_B_SAMB2501_0
(MOLYBDENUM COFACTOR
BIOSYNTHESIS PROTEIN
A)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 7 TYR A 412
GLU A 427
THR A 403
VAL A 367
 None
None
HEC  A1003 (-3.4A)
None
 1.04A 1tv8B-6btmA:
undetectable		 1tv8B-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1TW4_A_CHDA130_0
(FATTY ACID-BINDING
PROTEIN)		 1gq1 CYTOCHROME CD1
NITRITE REDUCTASE
(Paracoccus
pantotrophus) 		5 / 12 LEU A 128
LEU A  49
ALA A  57
ILE A  60
LEU A  81
 None
None
None
None
HEC  A 601 (-4.7A)
 1.01A 1tw4A-1gq1A:
0.7		 1tw4A-1gq1A:
14.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1UW6_A_NCTA1208_1
(ACETYLCHOLINE-BINDIN
G PROTEIN)		 1z1n SIXTEEN HEME
CYTOCHROME
(Desulfovibrio
gigas) 		4 / 8 THR X 406
CYH X 463
TYR X 439
LEU X 460
 None
HEC  X 613 (-1.9A)
HEC  X 613 (-3.5A)
None
 1.35A 1uw6A-1z1nX:
undetectable
1uw6B-1z1nX:
undetectable		 1uw6A-1z1nX:
14.64
1uw6B-1z1nX:
14.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1V54_C_CHDC3525_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE I
CYTOCHROME C OXIDASE
POLYPEPTIDE III)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 7 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.38A 1v54A-6btmA:
undetectable
1v54C-6btmA:
undetectable		 1v54A-6btmA:
undetectable
1v54C-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XLX_B_CIOB102_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B)		 3ufk UNDA
(Shewanella
sp.
HRCR_06) 		5 / 12 HIS A 755
ILE A 724
MET A 723
PHE A 720
PHE A 663
 HEC  A 909 (-3.1A)
HEC  A 909 ( 3.8A)
HEC  A 908 ( 3.7A)
HEC  A 909 (-4.4A)
HEC  A 908 ( 4.0A)
 1.26A 1xlxB-3ufkA:
undetectable		 1xlxB-3ufkA:
17.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1XVA_A_ACTA294_0
(GLYCINE
N-METHYLTRANSFERASE)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		4 / 5 ILE A 180
LEU A  91
ALA A 103
GLU A  94
 HEC  A 803 (-3.8A)
None
None
None
 1.21A 1xvaA-4lm8A:
undetectable
1xvaB-4lm8A:
undetectable		 1xvaA-4lm8A:
17.37
1xvaB-4lm8A:
17.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1YVM_A_TMGA501_1
(METHIONINE
AMINOPEPTIDASE)		 4fas HYDROXYLAMINE
OXIDOREDUCTASE
(Nitrosomonas
europaea) 		4 / 7 CYH A 172
CYH A 239
HIS A 243
HIS A  99
 HEC  A 603 ( 1.8A)
HEC  A 604 ( 1.8A)
HEC  A 604 (-3.3A)
HEC  A 603 ( 3.2A)
 1.46A 1yvmA-4fasA:
undetectable		 1yvmA-4fasA:
17.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ZLQ_A_ACTA1507_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 1tu2 APOCYTOCHROME F
(Nostoc
sp.
PCC
7119) 		3 / 3 GLN B 159
HIS B  26
ARG B 155
 None
HEC  B 255 (-3.3A)
None
 0.72A 1zlqA-1tu2B:
undetectable		 1zlqA-1tu2B:
18.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ZLQ_A_ACTA1507_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 2jxm CYTOCHROME F
(Prochlorothrix
hollandica) 		3 / 3 GLN B 160
HIS B  25
ARG B 156
 None
HEC  B 250 (-3.7A)
None
 0.61A 1zlqA-2jxmB:
undetectable		 1zlqA-2jxmB:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ZLQ_A_ACTA1507_0
(NICKEL-BINDING
PERIPLASMIC PROTEIN)		 5b82 TLL0287 PROTEIN
(Thermosynechococ
cus
elongatus) 		3 / 3 GLN A  88
HIS A  98
ARG A  94
 HEC  A 501 (-3.5A)
HEC  A 501 (-3.7A)
HEC  A 501 (-4.6A)
 0.90A 1zlqA-5b82A:
undetectable		 1zlqA-5b82A:
18.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ZZQ_A_MTLA870_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE
POLYSULPHIDE
REDUCTASE NRFD
QUINOL:CYTOCHROME C
OXIDOREDUCTASE
MONOHEME CYTOCHROME
SUBUNIT
(Rhodothermus
marinus;
Rhodothermus
marinus;
Rhodothermus
marinus) 		4 / 8 ARG C 142
PHE B 939
ASN E  37
ASP E  41
 None
None
HEC  A 301 (-2.9A)
None
 1.16A 1zzqA-6f0kC:
undetectable		 1zzqA-6f0kC:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ZZQ_B_MTLB871_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE
POLYSULPHIDE
REDUCTASE NRFD
QUINOL:CYTOCHROME C
OXIDOREDUCTASE
MONOHEME CYTOCHROME
SUBUNIT
(Rhodothermus
marinus;
Rhodothermus
marinus;
Rhodothermus
marinus) 		4 / 8 ARG C 142
PHE B 939
ASN E  37
ASP E  41
 None
None
HEC  A 301 (-2.9A)
None
 1.15A 1zzqB-6f0kC:
undetectable		 1zzqB-6f0kC:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ZZU_B_MTLB871_0
(NITRIC-OXIDE
SYNTHASE, BRAIN)		 6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE
POLYSULPHIDE
REDUCTASE NRFD
QUINOL:CYTOCHROME C
OXIDOREDUCTASE
MONOHEME CYTOCHROME
SUBUNIT
(Rhodothermus
marinus;
Rhodothermus
marinus;
Rhodothermus
marinus) 		4 / 8 ARG C 142
PHE B 939
ASN E  37
ASP E  41
 None
None
HEC  A 301 (-2.9A)
None
 1.13A 1zzuB-6f0kC:
undetectable		 1zzuB-6f0kC:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
209D_C_DVAC2_0
(N8-ACTINOMYCIN D)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		3 / 3 THR A 611
PRO A 609
THR A 613
 HEC  A 810 (-3.9A)
None
HEC  A 808 (-4.6A)
 0.72A 209dC-4lm8A:
undetectable		 209dC-4lm8A:
2.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
209D_C_DVAC8_0
(N8-ACTINOMYCIN D)		 2c1d SOXA
(Paracoccus
denitrificans) 		3 / 3 THR A 243
THR A 233
PRO A 232
 None
HEC  A1292 ( 4.5A)
None
 0.86A 209dC-2c1dA:
undetectable		 209dC-2c1dA:
3.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ACK_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 3s7w EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
nitratireducens) 		4 / 7 GLY A 489
GLU A 485
SER A 487
HIS A 491
 None
None
None
HEC  A1007 (-3.2A)
 1.13A 2ackA-3s7wA:
undetectable		 2ackA-3s7wA:
19.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ACK_A_EDRA999_1
(ACETYLCHOLINESTERASE)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		4 / 7 GLY A 489
GLU A 485
SER A 487
HIS A 491
 None
None
None
HEC  A1007 (-3.1A)
 1.16A 2ackA-3ttbA:
2.4		 2ackA-3ttbA:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AJV_L_COCL501_1
(ANTIBODY 7A1 FAB')		 2rf7 CYTOCHROME C-552
(Escherichia
coli) 		4 / 7 TYR A 184
ARG A 182
TYR A 267
PHE A 227
 None
HEC  A   3 ( 4.3A)
None
None
 1.21A 2ajvH-2rf7A:
undetectable
2ajvL-2rf7A:
undetectable		 2ajvH-2rf7A:
17.04
2ajvL-2rf7A:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AOI_C_FRDC305_2
(POL POLYPROTEIN
PEPTIDE INHIBITOR)		 1z1n SIXTEEN HEME
CYTOCHROME
(Desulfovibrio
gigas) 		4 / 5 LEU X 460
ASP X 458
PRO X 408
VAL X 407
 None
None
None
HEC  X 613 (-4.2A)
 0.99A 2aoiB-1z1nX:
undetectable		 2aoiB-1z1nX:
11.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2AVV_E_MK1E902_2
(POL POLYPROTEIN)		 2c1d SOXX
(Paracoccus
pantotrophus) 		3 / 3 ASP B  88
ILE B  67
VAL B  99
 None
None
HEC  B1158 ( 4.6A)
 0.61A 2avvD-2c1dB:
undetectable		 2avvD-2c1dB:
22.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BM9_F_SAMF301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 3ocd SOXX
(Starkeya
novella) 		5 / 12 GLY B 139
GLY B 123
ASN B 124
ALA B 105
ALA B 102
 None
HEC  B 401 (-3.6A)
None
None
None
 1.07A 2bm9F-3ocdB:
undetectable		 2bm9F-3ocdB:
21.83
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2BR4_A_SAMA301_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 3ocd SOXA
(Starkeya
novella) 		3 / 3 LYS A 274
ASP A 208
ASP A 203
 HEC  A 401 (-3.4A)
None
None
 1.11A 2br4A-3ocdA:
undetectable		 2br4A-3ocdA:
24.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2C49_B_ADNB1301_1
(SUGAR KINASE MJ0406)		 2vhd CYTOCHROME C551
PEROXIDASE
(Pseudomonas
aeruginosa) 		4 / 7 HIS A  55
ALA A  62
GLY A  60
GLY A  61
 HEC  A 401 (-3.3A)
None
None
None
 0.75A 2c49B-2vhdA:
undetectable		 2c49B-2vhdA:
20.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2C8A_C_NCAC1252_0
(MONO-ADP-RIBOSYLTRAN
SFERASE C3)		 3ufk UNDA
(Shewanella
sp.
HRCR_06) 		4 / 6 ARG A 732
SER A 733
ARG A 736
GLU A 715
 HEC  A 908 (-3.8A)
None
HEC  A 907 ( 3.2A)
None
 1.11A 2c8aC-3ufkA:
undetectable		 2c8aC-3ufkA:
13.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DCF_A_ACAA501_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)		 3vrc CYTOCHROME C'
(Thermochromatium
tepidum) 		4 / 6 ALA A  73
TYR A  16
TYR A  58
ILE A   9
 HEC  A 200 ( 4.1A)
HEC  A 200 (-3.6A)
None
HEC  A 200 ( 4.7A)
 1.21A 2dcfA-3vrcA:
undetectable		 2dcfA-3vrcA:
16.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2DYS_C_CHDC304_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		4 / 6 HIS A 190
ASP A 567
TYR A 569
HIS A 233
 HEC  A 801 (-3.2A)
HEC  A 806 ( 4.6A)
EDO  A 821 (-4.5A)
HEC  A 801 ( 3.3A)
 1.43A 2dysA-4lm8A:
undetectable
2dysC-4lm8A:
undetectable		 2dysA-4lm8A:
21.79
2dysC-4lm8A:
16.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2E7F_A_C2FA3000_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 1k3g CYTOCHROME C-553
(Sporosarcina
pasteurii) 		5 / 12 GLU A  57
ILE A  48
LEU A  40
GLY A  52
ILE A  60
 None
HEC  A  93 (-3.8A)
None
None
HEC  A  93 (-3.5A)
 1.29A 2e7fA-1k3gA:
undetectable		 2e7fA-1k3gA:
15.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2E7F_B_C2FB4000_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 1k3g CYTOCHROME C-553
(Sporosarcina
pasteurii) 		5 / 12 GLU A  57
ILE A  48
LEU A  40
GLY A  52
ILE A  60
 None
HEC  A  93 (-3.8A)
None
None
HEC  A  93 (-3.5A)
 1.26A 2e7fB-1k3gA:
undetectable		 2e7fB-1k3gA:
15.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIJ_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 7 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.37A 2eijA-6btmA:
undetectable
2eijC-6btmA:
undetectable		 2eijA-6btmA:
undetectable
2eijC-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIJ_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 7 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.33A 2eijN-6btmA:
undetectable
2eijP-6btmA:
undetectable		 2eijN-6btmA:
undetectable
2eijP-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIL_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		4 / 7 HIS A 190
ASP A 567
TYR A 569
HIS A 233
 HEC  A 801 (-3.2A)
HEC  A 806 ( 4.6A)
EDO  A 821 (-4.5A)
HEC  A 801 ( 3.3A)
 1.43A 2eilA-4lm8A:
undetectable
2eilC-4lm8A:
undetectable		 2eilA-4lm8A:
21.79
2eilC-4lm8A:
16.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIN_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 6 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.40A 2einA-6btmA:
undetectable
2einC-6btmA:
undetectable		 2einA-6btmA:
undetectable
2einC-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2EIN_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 6 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.39A 2einN-6btmA:
undetectable
2einP-6btmA:
undetectable		 2einN-6btmA:
undetectable
2einP-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2F8D_A_BEZA1001_0
(HTH-TYPE
TRANSCRIPTIONAL
REGULATOR BENM)		 2vhd CYTOCHROME C551
PEROXIDASE
(Pseudomonas
aeruginosa) 		4 / 6 SER A 168
ARG A 251
LEU A 250
PHE A 170
 None
None
HEC  A 402 (-4.9A)
None
 1.24A 2f8dA-2vhdA:
undetectable		 2f8dA-2vhdA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2FN1_B_SALB503_1
(SALICYLATE
SYNTHETASE, IRP9)		 2vhd CYTOCHROME C551
PEROXIDASE
(Pseudomonas
aeruginosa) 		5 / 11 ILE A 109
GLU A 160
HIS A  55
GLY A 107
GLU A 114
 None
HEC  A 401 (-3.5A)
HEC  A 401 (-3.3A)
None
HEC  A 401 (-4.0A)
 1.48A 2fn1B-2vhdA:
undetectable		 2fn1B-2vhdA:
22.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HW2_A_RFPA1200_1
(RIFAMPIN ADP-RIBOSYL
TRANSFERASE)		 5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCOP1
(Pseudomonas
stutzeri) 		5 / 12 ALA C 106
GLY C 111
GLY C 135
LEU C 293
LEU C 294
 None
None
None
None
HEC  C 402 ( 4.1A)
 1.04A 2hw2A-5djqC:
undetectable		 2hw2A-5djqC:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2IGT_A_SAMA1001_0
(SAM DEPENDENT
METHYLTRANSFERASE)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		5 / 12 SER A 100
ALA A 193
PRO A 182
GLY A  46
GLY A  44
 SO3  A1006 ( 2.6A)
SO3  A1006 (-4.2A)
HEC  A1002 (-4.6A)
None
None
 1.14A 2igtA-4wqeA:
undetectable		 2igtA-4wqeA:
21.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2KAW_A_SUZA91_1
(SEGMENT POLARITY
PROTEIN DISHEVELLED
HOMOLOG DVL-1)		 4aal CYTOCHROME C551
PEROXIDASE
(Geobacter
sulfurreducens) 		5 / 11 LEU A 302
GLY A 303
ILE A 304
SER A 305
VAL A 257
 HEC  A 424 ( 4.3A)
None
HEC  A 424 ( 4.2A)
None
None
 0.76A 2kawA-4aalA:
undetectable		 2kawA-4aalA:
15.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2M2O_B_DHIB24_0
(INSULIN B CHAIN)		 2jxm CYTOCHROME F
(Prochlorothrix
hollandica) 		4 / 6 GLY B 153
PHE B 236
LYS B  29
THR B  30
 None
HEC  B 250 ( 4.9A)
None
None
 1.35A 2m2oB-2jxmB:
undetectable		 2m2oB-2jxmB:
13.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2NOA_A_3TCA302_1
(DEOXYCYTIDINE KINASE)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		5 / 12 ILE A 225
GLU A 248
PHE A 269
ALA A 251
ARG A 189
 None
None
HEC  A 803 ( 3.9A)
HEC  A 803 ( 4.4A)
None
 1.41A 2noaA-4lmhA:
undetectable		 2noaA-4lmhA:
15.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2NOD_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		3 / 3 ARG A  67
ILE A 107
TRP A 136
 HEC  A 802 (-4.2A)
None
None
 1.08A 2nodB-1kb0A:
0.0		 2nodB-1kb0A:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OGY_A_C2FA3000_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 1k3g CYTOCHROME C-553
(Sporosarcina
pasteurii) 		5 / 12 GLU A  57
ILE A  48
LEU A  40
GLY A  52
ILE A  60
 None
HEC  A  93 (-3.8A)
None
None
HEC  A  93 (-3.5A)
 1.29A 2ogyA-1k3gA:
undetectable		 2ogyA-1k3gA:
15.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OGY_B_C2FB4000_0
(5-METHYLTETRAHYDROFO
LATE CORRINOID/IRON
SULFUR PROTEIN
METHYLTRANSFERASE)		 1k3g CYTOCHROME C-553
(Sporosarcina
pasteurii) 		5 / 12 GLU A  57
ILE A  48
LEU A  40
GLY A  52
ILE A  60
 None
HEC  A  93 (-3.8A)
None
None
HEC  A  93 (-3.5A)
 1.29A 2ogyB-1k3gA:
undetectable		 2ogyB-1k3gA:
15.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2OIP_D_MTXD617_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 1e29 CYTOCHROME C549
(Synechocystis
sp.) 		5 / 12 ALA A  62
LEU A  59
LEU A  72
PHE A  75
THR A  46
 HEC  A 201 (-3.6A)
HEC  A 201 (-4.5A)
HEC  A 201 (-4.9A)
HEC  A 201 (-4.1A)
HEC  A 201 ( 4.4A)
 1.16A 2oipD-1e29A:
undetectable		 2oipD-1e29A:
14.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PO5_B_CHDB503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1h29 HIGH-MOLECULAR-WEIGH
T CYTOCHROME C
(Desulfovibrio
vulgaris) 		3 / 3 LEU A 276
PRO A 277
LEU A 399
 None
HEC  A1112 (-3.7A)
None
 0.60A 2po5B-1h29A:
undetectable		 2po5B-1h29A:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PO7_B_CHDB503_0
(FERROCHELATASE,
MITOCHONDRIAL)		 1h29 HIGH-MOLECULAR-WEIGH
T CYTOCHROME C
(Desulfovibrio
vulgaris) 		3 / 3 LEU A 276
PRO A 277
LEU A 399
 None
HEC  A1112 (-3.7A)
None
 0.58A 2po7B-1h29A:
undetectable		 2po7B-1h29A:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2PRG_A_BRLA1_2
(PEROXISOME
PROLIFERATOR
ACTIVATED RECEPTOR
GAMMA)		 1h31 DIHEME CYTOCHROME C
(Rhodovulum
sulfidophilum) 		3 / 3 ILE A 165
ILE A 223
LEU A  24
 None
HEC  A1263 ( 4.9A)
None
 0.47A 2prgA-1h31A:
0.0		 2prgA-1h31A:
20.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QD2_A_CHDA2_0
(FERROCHELATASE)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		4 / 8 LEU A 113
PRO A  76
VAL A 103
MET A  71
 None
HEC  A 603 (-3.7A)
None
HEC  A 603 ( 2.4A)
 1.21A 2qd2A-4qo5A:
undetectable		 2qd2A-4qo5A:
22.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QD5_B_CHDB1104_0
(FERROCHELATASE)		 1h29 HIGH-MOLECULAR-WEIGH
T CYTOCHROME C
(Desulfovibrio
vulgaris) 		3 / 3 LEU A 276
PRO A 277
LEU A 399
 None
HEC  A1112 (-3.7A)
None
 0.46A 2qd5B-1h29A:
undetectable		 2qd5B-1h29A:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QEU_A_ACTA142_0
(PUTATIVE
CARBOXYMUCONOLACTONE
DECARBOXYLASE)		 1oae CYTOCHROME C'
(Methylophilus
methylotrophus) 		4 / 5 GLU A  69
PRO A  71
ILE A  70
GLY A  61
 None
HEC  A1125 (-4.2A)
HEC  A1125 (-4.4A)
None
 1.09A 2qeuA-1oaeA:
undetectable
2qeuC-1oaeA:
undetectable		 2qeuA-1oaeA:
21.23
2qeuC-1oaeA:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QHF_A_ACTA504_0
(CHORISMATE SYNTHASE)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		4 / 5 SER A 236
HIS A 232
LEU A 620
SER A 627
 None
HEC  A 801 (-3.2A)
HEC  A 801 ( 3.9A)
HEC  A 801 (-2.6A)
 1.45A 2qhfA-4lmhA:
undetectable		 2qhfA-4lmhA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2QMJ_A_ACRA1001_1
(MALTASE-GLUCOAMYLASE
, INTESTINAL)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		5 / 12 ASP A 450
ASN A 582
TRP A 660
ARG A 558
HIS A 639
 None
None
None
HEC  A 808 (-4.2A)
HEC  A 808 (-3.1A)
 1.38A 2qmjA-4lmhA:
undetectable		 2qmjA-4lmhA:
20.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2TSR_D_D16D609_1
(THYMIDYLATE SYNTHASE)		 3vrd FLAVOCYTOCHROME C
FLAVIN SUBUNIT
FLAVOCYTOCHROME C
HEME SUBUNIT
(Thermochromatium
tepidum) 		5 / 9 ILE A  29
ASP B 398
GLY A  16
TYR B  20
THR B 336
 HEC  A 201 ( 4.3A)
None
None
None
HEC  A 201 (-3.3A)
 1.49A 2tsrD-3vrdA:
undetectable		 2tsrD-3vrdA:
20.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VE3_B_REAB1445_1
(PUTATIVE CYTOCHROME
P450 120)		 2je2 CYTOCHROME P460
(Nitrosomonas
europaea) 		5 / 12 ALA A 144
PHE A  62
THR A  68
VAL A  46
GLY A  25
 None
None
HEC  A1171 (-3.8A)
HEC  A1171 (-4.4A)
None
 1.17A 2ve3B-2je2A:
undetectable		 2ve3B-2je2A:
16.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VH3_A_DAHA2_1
(RANASMURFIN)		 1c6s CYTOCHROME C6
(Synechococcus
elongatus) 		5 / 9 ALA A   7
GLY A  21
SER A  11
ALA A  15
CYH A  14
 None
None
None
None
HEC  A  88 (-1.8A)
 1.46A 2vh3A-1c6sA:
undetectable		 2vh3A-1c6sA:
22.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VMY_B_FFOB505_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 1zzh CYTOCHROME C
PEROXIDASE
(Rhodobacter
capsulatus) 		5 / 12 GLY A  63
HIS A  58
ASN A  82
PRO A 252
GLY A 251
 None
HEC  A 802 (-3.2A)
CA  A 401 (-3.0A)
None
None
 0.90A 2vmyA-1zzhA:
undetectable		 2vmyA-1zzhA:
26.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VMY_B_GLYB502_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 1jmz AMINE DEHYDROGENASE
(Pseudomonas
putida) 		4 / 8 SER A  28
HIS A  16
SER A  25
HIS A  29
 None
HEC  A1002 (-3.2A)
None
None
 1.33A 2vmyA-1jmzA:
undetectable
2vmyB-1jmzA:
undetectable		 2vmyA-1jmzA:
20.82
2vmyB-1jmzA:
20.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VMY_B_GLYB502_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 1ql4 CYTOCHROME C552
(Paracoccus
denitrificans) 		4 / 8 TYR A  46
HIS A  18
HIS A  29
ARG A  36
 HEC  A 101 (-4.5A)
HEC  A 101 (-3.2A)
None
HEC  A 101 (-4.0A)
 1.34A 2vmyA-1ql4A:
undetectable
2vmyB-1ql4A:
undetectable		 2vmyA-1ql4A:
14.82
2vmyB-1ql4A:
14.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VMY_B_GLYB502_0
(SERINE
HYDROXYMETHYLTRANSFE
RASE)		 3m97 CYTOCHROME C-552
(Paracoccus
denitrificans) 		4 / 8 TYR X  86
HIS X  58
HIS X  69
ARG X  76
 HEC  X 141 (-4.5A)
HEC  X 141 (-3.2A)
ZN  X 142 (-3.2A)
HEC  X 141 (-3.9A)
 1.32A 2vmyA-3m97X:
undetectable
2vmyB-3m97X:
undetectable		 2vmyA-3m97X:
17.50
2vmyB-3m97X:
17.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W3B_A_FOLA401_0
(DIHYDROFOLATE
REDUCTASE)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 12 ILE A 377
ALA A 537
LEU A 521
THR A 337
ILE A 335
 HEC  A 807 ( 4.4A)
None
None
None
None
 1.08A 2w3bA-4lm8A:
undetectable		 2w3bA-4lm8A:
13.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W8Y_A_486A1000_2
(PROGESTERONE
RECEPTOR)		 1m6z CYTOCHROME C4
(Pseudomonas
stutzeri) 		4 / 7 LEU A  32
GLU A  37
LEU A  41
MET A  66
 HEC  A 199 (-4.7A)
None
None
HEC  A 199 (-2.3A)
 1.18A 2w8yA-1m6zA:
0.0		 2w8yA-1m6zA:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2WLK_B_SPMB1302_1
(ATP-SENSITIVE INWARD
RECTIFIER POTASSIUM
CHANNEL 10)		 3zoy CYTOCHROME C-552
(Nitrosomonas
europaea) 		4 / 4 ALA A  39
TYR A  32
ALA A  43
TYR A  41
 None
HEC  A1082 (-4.4A)
None
HEC  A1082 (-4.5A)
 1.25A 2wlkA-3zoyA:
undetectable
2wlkB-3zoyA:
undetectable		 2wlkA-3zoyA:
13.15
2wlkB-3zoyA:
13.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X1L_A_ADNA601_1
(METHIONYL-TRNA
SYNTHETASE)		 2bh5 CYTOCHROME C-550
(Paracoccus
versutus) 		5 / 11 ALA X  48
HIS X  19
GLY X  36
GLY X  56
ILE X  59
 HEC  X1123 (-4.4A)
HEC  X1123 (-3.1A)
HEC  X1123 ( 3.9A)
HEC  X1123 (-3.7A)
HEC  X1123 (-4.3A)
 1.16A 2x1lA-2bh5X:
undetectable		 2x1lA-2bh5X:
17.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2X7H_A_PFNA1374_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)		 5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT II
(Pseudomonas
stutzeri) 		4 / 6 PRO B 138
GLU B  63
TYR B 140
CYH B  65
 HEC  B 301 (-4.5A)
None
HEC  B 301 (-3.4A)
HEC  B 301 (-1.7A)
 1.13A 2x7hA-5djqB:
undetectable		 2x7hA-5djqB:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XH9_A_J01A1436_1
(ORF12)		 1zrt CYTOCHROME B
CYTOCHROME C1
(Rhodobacter
capsulatus) 		4 / 8 VAL C 293
ARG D 107
GLY D 109
ALA D 108
 None
HEC  D 501 (-3.9A)
None
None
 0.93A 2xh9A-1zrtC:
undetectable		 2xh9A-1zrtC:
23.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y03_B_5FWB601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 2rf7 CYTOCHROME C-552
(Escherichia
coli) 		5 / 12 TRP A 270
THR A 281
VAL A 208
PHE A 196
TYR A 267
 HEC  A   4 (-4.1A)
None
None
None
None
 1.45A 2y03B-2rf7A:
2.3		 2y03B-2rf7A:
19.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y04_B_68HB601_1
(BETA-1 ADRENERGIC
RECEPTOR)		 2rf7 CYTOCHROME C-552
(Escherichia
coli) 		5 / 12 TRP A 270
THR A 281
VAL A 208
PHE A 196
TYR A 267
 HEC  A   4 (-4.1A)
None
None
None
None
 1.44A 2y04B-2rf7A:
undetectable		 2y04B-2rf7A:
19.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y69_A_CHDA1517_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 7 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.36A 2y69A-6btmA:
undetectable
2y69C-6btmA:
undetectable		 2y69A-6btmA:
undetectable
2y69C-6btmA:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YLD_A_ASCA130_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 5 ALA A  18
GLY A 116
CYH A 119
HIS A 123
 HEC  A 131 ( 3.8A)
None
HEC  A 131 (-1.8A)
HEC  A 131 (-3.1A)
 0.32A 2yldA-1gqaA:
17.6		 2yldA-1gqaA:
39.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YLD_A_ASCA130_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 5 GLY A 116
CYH A 119
LYS A 120
HIS A 123
 None
HEC  A 131 (-1.8A)
None
HEC  A 131 (-3.1A)
 0.52A 2yldA-1gqaA:
17.6		 2yldA-1gqaA:
39.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YLD_A_ASCA130_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 5 GLY A 117
CYH A 119
LYS A 120
HIS A 123
 None
HEC  A 131 (-1.8A)
None
HEC  A 131 (-3.1A)
 1.01A 2yldA-1gqaA:
17.6		 2yldA-1gqaA:
39.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YLD_A_ASCA130_0
(CYTOCHROME C')		 3vrc CYTOCHROME C'
(Thermochromatium
tepidum) 		4 / 5 ALA A  20
GLY A 118
CYH A 121
HIS A 125
 HEC  A 200 ( 3.8A)
None
HEC  A 200 (-1.9A)
HEC  A 200 (-3.3A)
 0.17A 2yldA-3vrcA:
17.2		 2yldA-3vrcA:
30.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YLD_A_ASCA130_0
(CYTOCHROME C')		 4cx9 CYTOCHROME C, CLASS
II
(Shewanella
frigidimarina) 		4 / 5 ALA A  20
GLY A 115
CYH A 118
LYS A 119
 HEC  A1129 (-3.5A)
None
HEC  A1129 (-1.9A)
None
 0.79A 2yldA-4cx9A:
19.9		 2yldA-4cx9A:
41.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YLD_A_ASCA130_0
(CYTOCHROME C')		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		5 / 5 ALA A  20
GLY A 113
CYH A 116
LYS A 117
HIS A 120
 ASC  A 202 ( 3.3A)
ASC  A 202 (-3.9A)
HEC  A 201 (-1.9A)
None
HEC  A 201 (-3.2A)
 0.35A 2yldA-5jt4A:
24.9		 2yldA-5jt4A:
99.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YLG_A_ASCA130_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		5 / 5 ALA A  18
GLY A 116
CYH A 119
LYS A 120
HIS A 123
 HEC  A 131 ( 3.8A)
None
HEC  A 131 (-1.8A)
None
HEC  A 131 (-3.1A)
 0.61A 2ylgA-1gqaA:
17.4		 2ylgA-1gqaA:
39.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YLG_A_ASCA130_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 5 GLY A 117
CYH A 119
LYS A 120
HIS A 123
 None
HEC  A 131 (-1.8A)
None
HEC  A 131 (-3.1A)
 0.98A 2ylgA-1gqaA:
17.4		 2ylgA-1gqaA:
39.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YLG_A_ASCA130_0
(CYTOCHROME C')		 3vrc CYTOCHROME C'
(Thermochromatium
tepidum) 		4 / 5 ALA A  20
GLY A 118
CYH A 121
HIS A 125
 HEC  A 200 ( 3.8A)
None
HEC  A 200 (-1.9A)
HEC  A 200 (-3.3A)
 0.23A 2ylgA-3vrcA:
17.4		 2ylgA-3vrcA:
30.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YLG_A_ASCA130_0
(CYTOCHROME C')		 4cx9 CYTOCHROME C, CLASS
II
(Shewanella
frigidimarina) 		4 / 5 ALA A  20
GLY A 115
CYH A 118
LYS A 119
 HEC  A1129 (-3.5A)
None
HEC  A1129 (-1.9A)
None
 0.38A 2ylgA-4cx9A:
19.9		 2ylgA-4cx9A:
41.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YLG_A_ASCA130_0
(CYTOCHROME C')		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		4 / 5 ALA A  16
CYH A 116
LYS A 117
HIS A 120
 HEC  A 201 (-3.4A)
HEC  A 201 (-1.9A)
None
HEC  A 201 (-3.2A)
 1.36A 2ylgA-5jt4A:
25.1		 2ylgA-5jt4A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2YLG_A_ASCA130_0
(CYTOCHROME C')		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		5 / 5 ALA A  20
GLY A 113
CYH A 116
LYS A 117
HIS A 120
 ASC  A 202 ( 3.3A)
ASC  A 202 (-3.9A)
HEC  A 201 (-1.9A)
None
HEC  A 201 (-3.2A)
 0.29A 2ylgA-5jt4A:
25.1		 2ylgA-5jt4A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZBZ_A_VDXA501_1
(CYTOCHROME P450-SU1)		 4aal CYTOCHROME C551
PEROXIDASE
(Geobacter
sulfurreducens) 		5 / 11 THR A  89
SER A 269
VAL A 287
MET A 297
ILE A 296
 None
HEC  A 424 (-3.4A)
None
HEC  A 424 (-2.3A)
None
 1.22A 2zbzA-4aalA:
undetectable		 2zbzA-4aalA:
22.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZXW_C_CHDC525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 6 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.34A 2zxwA-6btmA:
undetectable
2zxwC-6btmA:
undetectable		 2zxwA-6btmA:
undetectable
2zxwC-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZXW_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 6 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.35A 2zxwN-6btmA:
undetectable
2zxwP-6btmA:
undetectable		 2zxwN-6btmA:
undetectable
2zxwP-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ZXW_W_CHDW1060_0
(CYTOCHROME C OXIDASE
POLYPEPTIDE 7A1
CYTOCHROME C OXIDASE
SUBUNIT 1)		 4cx9 CYTOCHROME C, CLASS
II
(Shewanella
frigidimarina) 		4 / 7 ILE A  19
PHE A  16
MET A  85
THR A  86
 HEC  A1129 (-4.9A)
HEC  A1129 (-3.4A)
HEC  A1129 (-4.0A)
None
 1.22A 2zxwN-4cx9A:
3.0
2zxwW-4cx9A:
undetectable		 2zxwN-4cx9A:
11.29
2zxwW-4cx9A:
14.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ABM_P_CHDP1525_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 7 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.32A 3abmN-6btmA:
undetectable
3abmP-6btmA:
undetectable		 3abmN-6btmA:
undetectable
3abmP-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AI8_A_HNQA255_1
(CATHEPSIN B)		 3ufk UNDA
(Shewanella
sp.
HRCR_06) 		4 / 7 GLY A 303
HIS A 460
CYH A 386
HIS A 365
 HEC  A 903 (-3.4A)
HEC  A 904 ( 3.1A)
HEC  A 904 (-1.8A)
HEC  A 903 ( 3.1A)
 1.21A 3ai8A-3ufkA:
undetectable		 3ai8A-3ufkA:
13.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AI8_A_HNQA255_1
(CATHEPSIN B)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		4 / 7 GLN A 142
GLY A 259
HIS A 240
CYH A 253
 HEC  A 802 (-3.4A)
None
HEC  A 802 (-3.2A)
HEC  A 802 (-2.0A)
 0.71A 3ai8A-4lmhA:
undetectable		 3ai8A-4lmhA:
16.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AI8_B_HNQB255_1
(CATHEPSIN B)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		4 / 6 GLN A 142
GLY A 259
HIS A 240
CYH A 253
 HEC  A 802 (-3.4A)
None
HEC  A 802 (-3.2A)
HEC  A 802 (-2.0A)
 0.77A 3ai8B-4lmhA:
undetectable		 3ai8B-4lmhA:
16.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3AX9_B_SALB1340_1
(XANTHINE
DEHYDROGENASE/OXIDAS
E)		 4fas HYDROXYLAMINE
OXIDOREDUCTASE
(Nitrosomonas
europaea) 		4 / 8 GLU A 293
LEU A 114
ALA A 251
ALA A 250
 None
None
None
HEC  A 603 (-3.4A)
 0.93A 3ax9B-4fasA:
undetectable		 3ax9B-4fasA:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BJW_F_SVRF502_2
(PHOSPHOLIPASE A2)		 2c1u DI-HAEM CYTOCHROME C
PEROXIDASE
(Paracoccus
pantotrophus) 		4 / 5 ILE A  63
SER A  64
PRO A  55
PHE A  53
 HEC  A 401 (-4.6A)
None
None
None
 1.35A 3bjwC-2c1uA:
undetectable		 3bjwC-2c1uA:
16.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3BJW_G_SVRG506_3
(PHOSPHOLIPASE A2)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		3 / 3 PRO A 641
PHE A 650
LYS A 639
 HEC  A 802 (-3.9A)
HEC  A 802 (-3.6A)
None
 1.24A 3bjwG-1kb0A:
0.0		 3bjwG-1kb0A:
11.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3D4S_A_TIMA401_1
(BETA-2 ADRENERGIC
RECEPTOR/T4-LYSOZYME
CHIMERA)		 2rf7 CYTOCHROME C-552
(Escherichia
coli) 		5 / 12 TRP A 270
THR A 281
VAL A 208
PHE A 196
TYR A 267
 HEC  A   4 (-4.1A)
None
None
None
None
 1.47A 3d4sA-2rf7A:
undetectable		 3d4sA-2rf7A:
20.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3DQT_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		4 / 7 PHE A  79
GLU A  71
SER A  74
TRP A  73
 HEC  A 201 (-4.4A)
None
None
None
 1.19A 3dqtA-5jt4A:
undetectable
3dqtB-5jt4A:
2.2		 3dqtA-5jt4A:
15.09
3dqtB-5jt4A:
15.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3E23_A_SAMA221_1
(UNCHARACTERIZED
PROTEIN RPA2492)		 3vrd FLAVOCYTOCHROME C
HEME SUBUNIT
FLAVOCYTOCHROME C
FLAVIN SUBUNIT
(Thermochromatium
tepidum;
Thermochromatium
tepidum) 		3 / 3 TYR B 306
ASP B 398
HIS A  15
 None
None
HEC  A 201 (-3.2A)
 0.72A 3e23A-3vrdB:
1.8		 3e23A-3vrdB:
18.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3E68_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		3 / 3 ARG A  67
ILE A 107
TRP A 136
 HEC  A 802 (-4.2A)
None
None
 1.06A 3e68A-1kb0A:
0.0		 3e68A-1kb0A:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3E6T_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		3 / 3 ARG A  67
ILE A 107
TRP A 136
 HEC  A 802 (-4.2A)
None
None
 1.07A 3e6tB-1kb0A:
0.0		 3e6tB-1kb0A:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3E7I_B_H4BB2902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		3 / 3 ARG A  67
ILE A 107
TRP A 136
 HEC  A 802 (-4.2A)
None
None
 1.13A 3e7iB-1kb0A:
undetectable		 3e7iB-1kb0A:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EEY_A_SAMA300_0
(PUTATIVE RRNA
METHYLASE)		 3ubr CYTOCHROME C-552
(Shewanella
oneidensis) 		5 / 12 THR A 154
GLY A 156
ASP A 126
GLY A  90
ASN A 153
 None
HEC  A 472 (-4.0A)
None
HEC  A 473 ( 4.4A)
None
 1.06A 3eeyA-3ubrA:
undetectable		 3eeyA-3ubrA:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EEY_B_SAMB300_0
(PUTATIVE RRNA
METHYLASE)		 3ubr CYTOCHROME C-552
(Shewanella
oneidensis) 		5 / 12 THR A 154
GLY A 156
ASP A 126
GLY A  90
ASN A 153
 None
HEC  A 472 (-4.0A)
None
HEC  A 473 ( 4.4A)
None
 1.08A 3eeyB-3ubrA:
undetectable		 3eeyB-3ubrA:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EEY_C_SAMC300_0
(PUTATIVE RRNA
METHYLASE)		 3ubr CYTOCHROME C-552
(Shewanella
oneidensis) 		5 / 12 THR A 154
GLY A 156
ASP A 126
GLY A  90
ASN A 153
 None
HEC  A 472 (-4.0A)
None
HEC  A 473 ( 4.4A)
None
 1.09A 3eeyC-3ubrA:
undetectable		 3eeyC-3ubrA:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EEY_D_SAMD300_0
(PUTATIVE RRNA
METHYLASE)		 3ubr CYTOCHROME C-552
(Shewanella
oneidensis) 		5 / 12 THR A 154
GLY A 156
ASP A 126
GLY A  90
ASN A 153
 None
HEC  A 472 (-4.0A)
None
HEC  A 473 ( 4.4A)
None
 1.11A 3eeyD-3ubrA:
undetectable		 3eeyD-3ubrA:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EEY_F_SAMF300_0
(PUTATIVE RRNA
METHYLASE)		 3ubr CYTOCHROME C-552
(Shewanella
oneidensis) 		5 / 12 THR A 154
GLY A 156
ASP A 126
GLY A  90
ASN A 153
 None
HEC  A 472 (-4.0A)
None
HEC  A 473 ( 4.4A)
None
 1.08A 3eeyF-3ubrA:
undetectable		 3eeyF-3ubrA:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EEY_H_SAMH300_0
(PUTATIVE RRNA
METHYLASE)		 3ubr CYTOCHROME C-552
(Shewanella
oneidensis) 		5 / 12 THR A 154
GLY A 156
ASP A 126
GLY A  90
ASN A 153
 None
HEC  A 472 (-4.0A)
None
HEC  A 473 ( 4.4A)
None
 1.09A 3eeyH-3ubrA:
undetectable		 3eeyH-3ubrA:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EEY_I_SAMI300_0
(PUTATIVE RRNA
METHYLASE)		 3ubr CYTOCHROME C-552
(Shewanella
oneidensis) 		5 / 12 THR A 154
GLY A 156
ASP A 126
GLY A  90
ASN A 153
 None
HEC  A 472 (-4.0A)
None
HEC  A 473 ( 4.4A)
None
 1.09A 3eeyI-3ubrA:
undetectable		 3eeyI-3ubrA:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3EEY_J_SAMJ300_0
(PUTATIVE RRNA
METHYLASE)		 3ubr CYTOCHROME C-552
(Shewanella
oneidensis) 		5 / 12 THR A 154
GLY A 156
ASP A 126
GLY A  90
ASN A 153
 None
HEC  A 472 (-4.0A)
None
HEC  A 473 ( 4.4A)
None
 1.07A 3eeyJ-3ubrA:
undetectable		 3eeyJ-3ubrA:
16.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ELZ_B_CHDB152_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 1zzh CYTOCHROME C
PEROXIDASE
(Rhodobacter
capsulatus) 		3 / 3 ASN A  82
HIS A 264
VAL A 219
 CA  A 401 (-3.0A)
ZN  A 402 ( 3.6A)
HEC  A 803 (-3.9A)
 0.89A 3elzB-1zzhA:
undetectable		 3elzB-1zzhA:
17.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ELZ_B_CHDB152_0
(ILEAL BILE
ACID-BINDING PROTEIN)		 4aal CYTOCHROME C551
PEROXIDASE
(Geobacter
sulfurreducens) 		3 / 3 ASN A 101
HIS A 283
VAL A 238
 CA  A 425 (-2.9A)
HEC  A 424 (-3.5A)
HEC  A 424 (-4.0A)
 0.88A 3elzB-4aalA:
undetectable		 3elzB-4aalA:
17.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ETE_F_H3PF552_1
(GLUTAMATE
DEHYDROGENASE)		 4cx9 CYTOCHROME C, CLASS
II
(Shewanella
frigidimarina) 		4 / 7 ILE A  60
LYS A  65
ILE A   9
TYR A  11
 SO4  A1132 ( 3.9A)
None
HEC  A1129 ( 4.7A)
None
 1.16A 3eteD-4cx9A:
undetectable
3eteF-4cx9A:
undetectable		 3eteD-4cx9A:
14.46
3eteF-4cx9A:
14.46
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3F8W_A_ADNA300_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		5 / 12 GLY A 196
GLY A 194
ASN A 205
HIS A 524
VAL A 204
 HEM  A 612 (-3.3A)
None
HEC  A 610 ( 3.5A)
None
None
 1.12A 3f8wA-4n4kA:
undetectable		 3f8wA-4n4kA:
19.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3F8W_B_ADNB301_1
(PURINE-NUCLEOSIDE
PHOSPHORYLASE)		 4n4k HYDROXYLAMINE
OXIDOREDUCTASE
(Candidatus
Kuenenia
stuttgartiensis) 		5 / 12 GLY A 196
GLY A 194
ASN A 205
HIS A 524
VAL A 204
 HEM  A 612 (-3.3A)
None
HEC  A 610 ( 3.5A)
None
None
 1.10A 3f8wB-4n4kA:
undetectable		 3f8wB-4n4kA:
19.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FSU_E_C2FE995_0
(5,10-METHYLENETETRAH
YDROFOLATE REDUCTASE)		 2rf7 CYTOCHROME C-552
(Escherichia
coli) 		5 / 11 THR A 313
ASP A 300
GLN A  62
SER A 387
THR A  59
 None
None
HEC  A   3 (-3.8A)
None
None
 1.35A 3fsuE-2rf7A:
0.0		 3fsuE-2rf7A:
21.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3FZG_A_SAMA300_0
(16S RRNA METHYLASE)		 2jxm CYTOCHROME F
(Prochlorothrix
hollandica) 		5 / 12 THR B 105
GLY B 118
LEU B 103
MET B 128
VAL B  49
 None
HEC  B 250 ( 4.3A)
None
None
None
 1.14A 3fzgA-2jxmB:
undetectable		 3fzgA-2jxmB:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HJ3_D_MTXD615_1
(CHAIN A, CRYSTAL
STRUCTURE OF DHFR)		 1e29 CYTOCHROME C549
(Synechocystis
sp.) 		5 / 12 ALA A  62
LEU A  59
LEU A  72
PHE A  75
THR A  46
 HEC  A 201 (-3.6A)
HEC  A 201 (-4.5A)
HEC  A 201 (-4.9A)
HEC  A 201 (-4.1A)
HEC  A 201 ( 4.4A)
 1.09A 3hj3D-1e29A:
undetectable		 3hj3D-1e29A:
13.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IJD_A_C2FA314_0
(UNCHARACTERIZED
PROTEIN)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		5 / 12 GLY A 285
LEU A 286
ILE A 193
ARG A 282
GLN A 190
 None
None
HEC  A1002 (-4.1A)
HEC  A1002 (-3.0A)
None
 1.13A 3ijdA-3ttbA:
undetectable		 3ijdA-3ttbA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IJD_B_C2FB314_0
(UNCHARACTERIZED
PROTEIN)		 3s7w EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
nitratireducens) 		5 / 12 GLY A 285
LEU A 286
ILE A 193
ARG A 282
GLN A 190
 None
None
HEC  A1002 ( 4.2A)
HEC  A1002 (-3.1A)
None
 1.11A 3ijdB-3s7wA:
undetectable		 3ijdB-3s7wA:
18.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IJD_B_C2FB314_0
(UNCHARACTERIZED
PROTEIN)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		5 / 12 GLY A 285
LEU A 286
ILE A 193
ARG A 282
GLN A 190
 None
None
HEC  A1002 (-4.1A)
HEC  A1002 (-3.0A)
None
 1.11A 3ijdB-3ttbA:
undetectable		 3ijdB-3ttbA:
20.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KEE_B_30BB500_2
(GENOME POLYPROTEIN)		 6f0k ACTD
(Rhodothermus
marinus) 		3 / 3 PHE D 110
TYR D 101
LEU D 113
 None
HEC  A 301 (-4.3A)
None
 0.67A 3keeB-6f0kD:
undetectable		 3keeB-6f0kD:
16.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KM6_A_EAAA222_1
(GLUTATHIONE
S-TRANSFERASE P)		 4aal CYTOCHROME C551
PEROXIDASE
(Geobacter
sulfurreducens) 		5 / 10 GLY A  82
TRP A 116
GLN A  96
ILE A  86
ASN A  78
 None
None
HEC  A 423 (-3.6A)
None
None
 1.24A 3km6A-4aalA:
undetectable		 3km6A-4aalA:
22.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_M_TFPM201_1
(PROTEIN S100-A4)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		4 / 7 GLY A 668
CYH A 604
PHE A 606
GLY A 612
 None
HEC  A 802 (-1.8A)
None
None
 0.97A 3ko0M-1kb0A:
undetectable
3ko0P-1kb0A:
undetectable		 3ko0M-1kb0A:
9.17
3ko0P-1kb0A:
9.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3KO0_P_TFPP201_1
(PROTEIN S100-A4)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		4 / 7 GLY A 612
GLY A 668
CYH A 604
PHE A 606
 None
None
HEC  A 802 (-1.8A)
None
 0.96A 3ko0M-1kb0A:
undetectable
3ko0P-1kb0A:
undetectable		 3ko0M-1kb0A:
9.17
3ko0P-1kb0A:
9.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MEK_A_SAMA510_0
(SET AND MYND
DOMAIN-CONTAINING
PROTEIN 3)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		5 / 12 GLY A 376
ASN A 375
GLU A 373
ASN A 492
HIS A 383
 None
HEC  A1008 ( 4.0A)
None
None
HEC  A1007 ( 3.1A)
 1.36A 3mekA-3ttbA:
undetectable		 3mekA-3ttbA:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MNE_A_DEXA784_1
(GLUCOCORTICOID
RECEPTOR)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 12 GLY A 514
MET A 517
LEU A 521
THR A 540
ILE A 377
 None
HEC  A 807 ( 3.8A)
None
HEC  A 807 (-4.7A)
HEC  A 807 ( 4.4A)
 1.49A 3mneA-4lm8A:
undetectable		 3mneA-4lm8A:
16.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3N0H_A_TOPA187_1
(DIHYDROFOLATE
REDUCTASE)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 11 ILE A 377
ALA A 537
THR A 337
ILE A 335
LEU A 374
 HEC  A 807 ( 4.4A)
None
None
None
None
 1.01A 3n0hA-4lm8A:
undetectable		 3n0hA-4lm8A:
13.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NDI_A_SAMA601_1
(METHYLTRANSFERASE)		 3ubr CYTOCHROME C-552
(Shewanella
oneidensis) 		5 / 9 GLY A 266
GLU A 389
PRO A 388
ASN A 271
HIS A 268
 None
HEC  A 475 ( 4.5A)
None
HEC  A 475 (-3.7A)
HEC  A 474 ( 2.9A)
 1.31A 3ndiA-3ubrA:
0.0		 3ndiA-3ubrA:
22.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NW2_A_H4BA902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		3 / 3 ARG A  67
ILE A 107
TRP A 136
 HEC  A 802 (-4.2A)
None
None
 1.07A 3nw2A-1kb0A:
0.0		 3nw2A-1kb0A:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NW2_B_H4BB902_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		3 / 3 ARG A  67
ILE A 107
TRP A 136
 HEC  A 802 (-4.2A)
None
None
 1.12A 3nw2B-1kb0A:
undetectable		 3nw2B-1kb0A:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3OKX_A_SAMA201_0
(YAEB-LIKE PROTEIN
RPA0152)		 5c2v HYDRAZINE SYNTHASE
ALPHA SUBUNIT
(Candidatus
Kuenenia
stuttgartiensis) 		5 / 12 LEU A 745
LEU A 697
PRO A 695
GLY A 698
SER A 713
 HEC  A 906 (-4.8A)
None
None
None
None
 1.38A 3okxA-5c2vA:
undetectable		 3okxA-5c2vA:
13.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3P2K_B_SAMB6735_0
(16S RRNA METHYLASE)		 1e2z CYTOCHROME F
(Chlamydomonas
reinhardtii) 		5 / 12 GLY A 236
GLY A 155
ASN A 168
VAL A  71
ALA A  30
 None
HEC  A 900 (-3.5A)
None
HEC  A 900 (-4.7A)
None
 1.12A 3p2kB-1e2zA:
undetectable		 3p2kB-1e2zA:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3P2K_B_SAMB6735_0
(16S RRNA METHYLASE)		 2jxm CYTOCHROME F
(Prochlorothrix
hollandica) 		5 / 12 GLY B 235
GLY B 157
ASN B 170
VAL B  71
GLU B  32
 None
HEC  B 250 (-3.4A)
None
HEC  B 250 (-4.1A)
None
 1.11A 3p2kB-2jxmB:
undetectable		 3p2kB-2jxmB:
19.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3QWP_A_SAMA510_0
(SET AND MYND
DOMAIN-CONTAINING
PROTEIN 3)		 3ufk UNDA
(Shewanella
sp.
HRCR_06) 		5 / 12 ARG A 536
GLY A 535
ASN A 539
CYH A 702
HIS A 709
 HEC  A 907 (-3.8A)
None
None
HEC  A 908 (-2.0A)
HEC  A 907 ( 3.1A)
 1.32A 3qwpA-3ufkA:
undetectable		 3qwpA-3ufkA:
18.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RQL_B_H4BB760_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		4 / 8 TRP A 278
PHE A 275
GLU A 280
SER A 281
 HEC  A 607 (-4.7A)
None
None
None
 1.32A 3rqlA-4qo5A:
2.6
3rqlB-4qo5A:
undetectable		 3rqlA-4qo5A:
21.94
3rqlB-4qo5A:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3RV5_B_DXCB92_0
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 3ubr CYTOCHROME C-552
(Shewanella
oneidensis) 		4 / 5 VAL A  95
VAL A  98
ARG A  99
LYS A 143
 None
HEC  A 471 ( 4.7A)
None
None
 1.17A 3rv5A-3ubrA:
undetectable
3rv5B-3ubrA:
undetectable		 3rv5A-3ubrA:
13.85
3rv5B-3ubrA:
13.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3S3V_A_TOPA187_1
(DIHYDROFOLATE
REDUCTASE)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 12 ILE A 377
ALA A 537
THR A 337
ILE A 335
LEU A 374
 HEC  A 807 ( 4.4A)
None
None
None
None
 0.98A 3s3vA-4lm8A:
undetectable		 3s3vA-4lm8A:
13.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SFU_C_RBVC601_1
(RNA POLYMERASE)		 5c2w HYPOTHETICAL (DI
HEME) PROTEIN
(Candidatus
Kuenenia
stuttgartiensis) 		5 / 11 LYS C 131
ASP C 312
THR C 250
GLY C 251
ASP C 290
 HEC  C 404 (-4.2A)
None
HEC  C 405 (-3.1A)
None
None
 1.43A 3sfuC-5c2wC:
undetectable		 3sfuC-5c2wC:
21.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SMT_A_ACTA500_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD3)		 2c1u DI-HAEM CYTOCHROME C
PEROXIDASE
(Paracoccus
pantotrophus) 		3 / 3 PHE A 228
SER A 291
GLN A 293
 HEC  A 402 (-4.5A)
None
None
 0.78A 3smtA-2c1uA:
undetectable		 3smtA-2c1uA:
21.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SUD_C_SUEC1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 1zrt CYTOCHROME B
CYTOCHROME C1
(Rhodobacter
capsulatus) 		5 / 12 ASP C 278
ILE D 131
GLY D 126
ALA D 106
ALA D 104
 None
HEC  D 501 ( 4.9A)
None
None
None
 0.99A 3sudC-1zrtC:
undetectable		 3sudC-1zrtC:
19.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SUF_D_SUED1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 1zrt CYTOCHROME B
CYTOCHROME C1
(Rhodobacter
capsulatus) 		5 / 12 ASP C 278
ILE D 131
GLY D 126
ALA D 106
ALA D 104
 None
HEC  D 501 ( 4.9A)
None
None
None
 0.97A 3sufD-1zrtC:
undetectable		 3sufD-1zrtC:
19.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3T3Q_A_9PLA501_1
(CYTOCHROME P450 2A6)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 10 ASN A 584
PHE A 583
THR A 613
ILE A 610
PHE A 656
 None
HEC  A 808 (-4.1A)
HEC  A 808 (-4.6A)
None
None
 1.33A 3t3qA-4lm8A:
undetectable		 3t3qA-4lm8A:
22.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TKD_A_CYZA266_2
(GLUTAMATE RECEPTOR 2)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		4 / 5 ILE A 299
PRO A 129
LYS A 304
GLY A 303
 None
None
HEC  A 802 ( 4.4A)
None
 1.11A 3tkdB-4lmhA:
undetectable		 3tkdB-4lmhA:
15.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TKD_B_CYZB267_1
(GLUTAMATE RECEPTOR 2)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		4 / 5 ILE A 299
PRO A 129
LYS A 304
GLY A 303
 None
None
HEC  A 802 ( 4.4A)
None
 1.09A 3tkdA-4lmhA:
undetectable		 3tkdA-4lmhA:
15.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TVX_B_PNXB902_1
(CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4A)		 3vrd FLAVOCYTOCHROME C
HEME SUBUNIT
(Thermochromatium
tepidum) 		4 / 7 TYR A  72
ASN A   9
PHE A  37
MET A  41
 None
None
HEC  A 201 (-4.6A)
HEC  A 201 (-3.6A)
 1.27A 3tvxB-3vrdA:
undetectable		 3tvxB-3vrdA:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V3O_A_T1CA404_1
(TETX2 PROTEIN)		 4cx9 CYTOCHROME C, CLASS
II
(Shewanella
frigidimarina) 		5 / 12 PHE A  23
ASN A  47
GLY A  24
ALA A 110
ASN A 113
 HEC  A1129 ( 4.0A)
None
None
None
None
 1.22A 3v3oA-4cx9A:
undetectable		 3v3oA-4cx9A:
16.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3V3O_B_T1CB405_1
(TETX2 PROTEIN)		 4cx9 CYTOCHROME C, CLASS
II
(Shewanella
frigidimarina) 		5 / 12 PHE A  23
ASN A  47
GLY A  24
ALA A 110
ASN A 113
 HEC  A1129 ( 4.0A)
None
None
None
None
 1.19A 3v3oB-4cx9A:
undetectable		 3v3oB-4cx9A:
16.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W37_A_ACRA1001_1
(ALPHA-GLUCOSIDASE)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		5 / 12 ALA A 174
ASP A  34
ARG A 177
ASP A 173
HIS A  51
 None
None
None
None
HEC  A1002 (-4.9A)
 1.47A 3w37A-4wqeA:
undetectable		 3w37A-4wqeA:
15.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W9T_B_W9TB513_1
(HEMOLYTIC LECTIN
CEL-III)		 2rf7 CYTOCHROME C-552
(Escherichia
coli) 		4 / 6 CYH A 282
THR A 281
CYH A 209
ILE A 303
 HEC  A   4 (-1.6A)
None
HEC  A   3 (-1.6A)
HEC  A   3 (-4.3A)
 1.15A 3w9tB-2rf7A:
undetectable		 3w9tB-2rf7A:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WDM_A_ADNA901_1
(4-PHOSPHOPANTOATE--B
ETA-ALANINE LIGASE)		 4y5r METHYLAMINE
UTILIZATION PROTEIN
MAUG
(Paracoccus
denitrificans) 		5 / 9 ALA A 326
LEU A 328
LEU A 323
ASN A 225
ILE A 226
 None
None
None
None
HEC  A 403 ( 4.5A)
 1.46A 3wdmA-4y5rA:
undetectable		 3wdmA-4y5rA:
22.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WEL_A_ACRA1001_1
(ALPHA-GLUCOSIDASE)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		5 / 12 ALA A 174
ASP A  34
ARG A 177
ASP A 173
HIS A  51
 None
None
None
None
HEC  A1002 (-4.9A)
 1.47A 3welA-4wqeA:
undetectable		 3welA-4wqeA:
15.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WEM_A_ACRA1001_1
(ALPHA-GLUCOSIDASE)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		5 / 12 ALA A 174
ASP A  34
ARG A 177
ASP A 173
HIS A  51
 None
None
None
None
HEC  A1002 (-4.9A)
 1.45A 3wemA-4wqeA:
undetectable		 3wemA-4wqeA:
15.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WEN_A_ACRA1001_1
(ALPHA-GLUCOSIDASE)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		5 / 12 ALA A 174
ASP A  34
ARG A 177
ASP A 173
HIS A  51
 None
None
None
None
HEC  A1002 (-4.9A)
 1.47A 3wenA-4wqeA:
undetectable		 3wenA-4wqeA:
15.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3WEO_A_ACRA1001_1
(ALPHA-GLUCOSIDASE)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		5 / 12 ALA A 174
ASP A  34
ARG A 177
ASP A 173
HIS A  51
 None
None
None
None
HEC  A1002 (-4.9A)
 1.46A 3weoA-4wqeA:
undetectable		 3weoA-4wqeA:
15.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ZQE_B_DXCB1079_0
(PROTEIN PRGI, CELL
INVASION PROTEIN
SIPD)		 5c2v HYDRAZINE SYNTHASE
ALPHA SUBUNIT
(Candidatus
Kuenenia
stuttgartiensis) 		5 / 11 PRO A 474
SER A 738
THR A 571
LEU A 570
TYR A 554
 None
None
HEC  A 905 (-3.7A)
HEC  A 905 (-4.1A)
None
 1.25A 3zqeA-5c2vA:
undetectable
3zqeB-5c2vA:
undetectable		 3zqeA-5c2vA:
17.24
3zqeB-5c2vA:
17.24
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ZWI_A_ASCA156_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 5 ALA A  18
GLY A 116
CYH A 119
HIS A 123
 HEC  A 131 ( 3.8A)
None
HEC  A 131 (-1.8A)
HEC  A 131 (-3.1A)
 0.32A 3zwiA-1gqaA:
17.6		 3zwiA-1gqaA:
39.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ZWI_A_ASCA156_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 5 GLY A 116
CYH A 119
LYS A 120
HIS A 123
 None
HEC  A 131 (-1.8A)
None
HEC  A 131 (-3.1A)
 0.51A 3zwiA-1gqaA:
17.6		 3zwiA-1gqaA:
39.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ZWI_A_ASCA156_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 5 GLY A 117
CYH A 119
LYS A 120
HIS A 123
 None
HEC  A 131 (-1.8A)
None
HEC  A 131 (-3.1A)
 1.06A 3zwiA-1gqaA:
17.6		 3zwiA-1gqaA:
39.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ZWI_A_ASCA156_0
(CYTOCHROME C')		 3vrc CYTOCHROME C'
(Thermochromatium
tepidum) 		4 / 5 ALA A  20
GLY A 118
CYH A 121
HIS A 125
 HEC  A 200 ( 3.8A)
None
HEC  A 200 (-1.9A)
HEC  A 200 (-3.3A)
 0.18A 3zwiA-3vrcA:
17.2		 3zwiA-3vrcA:
30.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ZWI_A_ASCA156_0
(CYTOCHROME C')		 4cx9 CYTOCHROME C, CLASS
II
(Shewanella
frigidimarina) 		4 / 5 ALA A  20
GLY A 115
CYH A 118
LYS A 119
 HEC  A1129 (-3.5A)
None
HEC  A1129 (-1.9A)
None
 0.79A 3zwiA-4cx9A:
19.9		 3zwiA-4cx9A:
41.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ZWI_A_ASCA156_0
(CYTOCHROME C')		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		5 / 5 ALA A  20
GLY A 113
CYH A 116
LYS A 117
HIS A 120
 ASC  A 202 ( 3.3A)
ASC  A 202 (-3.9A)
HEC  A 201 (-1.9A)
None
HEC  A 201 (-3.2A)
 0.36A 3zwiA-5jt4A:
24.9		 3zwiA-5jt4A:
99.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A6N_A_T1CA392_1
(TETX2 PROTEIN)		 4cx9 CYTOCHROME C, CLASS
II
(Shewanella
frigidimarina) 		5 / 11 PHE A  23
ASN A  47
GLY A  24
ALA A 110
ASN A 113
 HEC  A1129 ( 4.0A)
None
None
None
None
 1.22A 4a6nA-4cx9A:
undetectable		 4a6nA-4cx9A:
15.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4A99_C_MIYC391_1
(TETX2 PROTEIN)		 1tu2 APOCYTOCHROME F
(Nostoc
sp.
PCC
7119) 		5 / 11 ASN B 170
GLN B 159
ASN B  24
GLY B 158
SER B 167
 None
None
None
HEC  B 255 (-3.7A)
HEC  B 255 ( 4.0A)
 1.47A 4a99C-1tu2B:
undetectable		 4a99C-1tu2B:
20.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4AX8_A_SAMA1474_1
(WBDD)		 4fas HYDROXYLAMINE
OXIDOREDUCTASE
(Nitrosomonas
europaea) 		4 / 6 TYR A  33
GLN A 236
ARG A 183
ASP A  59
 None
None
HEC  A 604 ( 4.3A)
None
 1.34A 4ax8A-4fasA:
undetectable		 4ax8A-4fasA:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4AZV_A_SAMA1474_1
(WBDD)		 4fas HYDROXYLAMINE
OXIDOREDUCTASE
(Nitrosomonas
europaea) 		4 / 6 TYR A  33
GLN A 236
ARG A 183
ASP A  59
 None
None
HEC  A 604 ( 4.3A)
None
 1.33A 4azvA-4fasA:
undetectable		 4azvA-4fasA:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4B7N_A_ZMRA601_2
(NEURAMINIDASE)		 2c1d SOXA
(Paracoccus
denitrificans) 		3 / 3 ARG A  73
ARG A  68
TRP A  65
 None
HEC  A1292 (-3.1A)
None
 0.66A 4b7nA-2c1dA:
undetectable		 4b7nA-2c1dA:
19.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4BLV_A_SAMA1281_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE J)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		5 / 12 LEU A  47
ASP A 167
GLY A 170
HIS A  51
GLY A 185
 HEC  A1001 (-4.2A)
None
None
HEC  A1002 (-4.9A)
IOD  A1004 ( 4.5A)
 1.08A 4blvA-4wqeA:
undetectable		 4blvA-4wqeA:
24.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4CIP_A_ASCA130_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 4 ALA A  18
GLY A 116
CYH A 119
HIS A 123
 HEC  A 131 ( 3.8A)
None
HEC  A 131 (-1.8A)
HEC  A 131 (-3.1A)
 0.32A 4cipA-1gqaA:
17.7		 4cipA-1gqaA:
39.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4CIP_A_ASCA130_0
(CYTOCHROME C')		 3vrc CYTOCHROME C'
(Thermochromatium
tepidum) 		4 / 4 ALA A  20
GLY A 118
CYH A 121
HIS A 125
 HEC  A 200 ( 3.8A)
None
HEC  A 200 (-1.9A)
HEC  A 200 (-3.3A)
 0.19A 4cipA-3vrcA:
17.3		 4cipA-3vrcA:
30.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4CIP_A_ASCA130_0
(CYTOCHROME C')		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		4 / 4 ALA A  20
GLY A 113
CYH A 116
HIS A 120
 ASC  A 202 ( 3.3A)
ASC  A 202 (-3.9A)
HEC  A 201 (-1.9A)
HEC  A 201 (-3.2A)
 0.10A 4cipA-5jt4A:
25.0		 4cipA-5jt4A:
99.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CPZ_C_ZMRC1470_2
(NEURAMINIDASE)		 2c1d SOXA
(Paracoccus
denitrificans) 		3 / 3 ARG A  73
ARG A  68
TRP A  65
 None
HEC  A1292 (-3.1A)
None
 0.67A 4cpzC-2c1dA:
undetectable		 4cpzC-2c1dA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CPZ_E_ZMRE1471_2
(NEURAMINIDASE)		 2c1d SOXA
(Paracoccus
denitrificans) 		3 / 3 ARG A  73
ARG A  68
TRP A  65
 None
HEC  A1292 (-3.1A)
None
 0.64A 4cpzE-2c1dA:
undetectable		 4cpzE-2c1dA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CPZ_F_ZMRF1470_2
(NEURAMINIDASE)		 2c1d SOXA
(Paracoccus
denitrificans) 		3 / 3 ARG A  73
ARG A  68
TRP A  65
 None
HEC  A1292 (-3.1A)
None
 0.69A 4cpzF-2c1dA:
undetectable		 4cpzF-2c1dA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CPZ_G_ZMRG1471_2
(NEURAMINIDASE)		 2c1d SOXA
(Paracoccus
denitrificans) 		3 / 3 ARG A  73
ARG A  68
TRP A  65
 None
HEC  A1292 (-3.1A)
None
 0.72A 4cpzG-2c1dA:
undetectable		 4cpzG-2c1dA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CPZ_H_ZMRH1470_2
(NEURAMINIDASE)		 2c1d SOXA
(Paracoccus
denitrificans) 		3 / 3 ARG A  73
ARG A  68
TRP A  65
 None
HEC  A1292 (-3.1A)
None
 0.64A 4cpzH-2c1dA:
undetectable		 4cpzH-2c1dA:
18.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4CX7_A_H4BA600_1
(NITRIC OXIDE
SYNTHASE, INDUCIBLE)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		4 / 8 SER A 281
TRP A 278
PHE A 275
GLU A 280
 None
HEC  A 607 (-4.7A)
None
None
 1.26A 4cx7A-4qo5A:
undetectable
4cx7B-4qo5A:
undetectable		 4cx7A-4qo5A:
20.26
4cx7B-4qo5A:
20.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4DXU_A_ACAA711_1
(LACTOTRANSFERRIN)		 2jxm CYTOCHROME F
(Prochlorothrix
hollandica) 		4 / 6 GLY B 165
VAL B 161
PRO B 163
TYR B   4
 None
HEC  B 250 (-4.8A)
HEC  B 250 (-2.5A)
HEC  B 250 ( 4.7A)
 0.74A 4dxuA-2jxmB:
undetectable		 4dxuA-2jxmB:
20.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4E47_C_SAMC800_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SETD7)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		5 / 11 ILE A 159
ALA A 155
GLY A 154
ASN A 226
HIS A 126
 None
None
None
None
HEC  A1004 (-4.4A)
 1.24A 4e47C-3ttbA:
undetectable		 4e47C-3ttbA:
20.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEV_A_KANA301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 3ubr CYTOCHROME C-552
(Shewanella
oneidensis) 		5 / 10 SER A  32
ASP A 126
ARG A 169
GLU A  40
ASP A 159
 None
None
None
None
HEC  A 473 (-3.7A)
 1.47A 4fevA-3ubrA:
0.0		 4fevA-3ubrA:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FEV_E_KANE301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 11 SER A 298
HIS A 297
ASN A 305
CYH A 306
ASP A 302
 HEC  A 805 ( 4.5A)
HEC  A 805 (-3.2A)
EDO  A 820 ( 3.1A)
HEC  A 805 (-1.7A)
None
 1.49A 4fevE-4lm8A:
undetectable		 4fevE-4lm8A:
16.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FFW_B_715B801_2
(DIPEPTIDYL PEPTIDASE
4)		 4fas HYDROXYLAMINE
OXIDOREDUCTASE
(Nitrosomonas
europaea) 		3 / 3 ARG A 165
TYR A 208
ASN A 241
 None
None
HEC  A 605 (-3.5A)
 0.90A 4ffwB-4fasA:
undetectable		 4ffwB-4fasA:
20.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FVQ_A_ACTA904_0
(TYROSINE-PROTEIN
KINASE JAK2)		 2c1u DI-HAEM CYTOCHROME C
PEROXIDASE
(Paracoccus
pantotrophus) 		3 / 3 PHE A 274
VAL A 279
GLU A 284
 HEC  A 402 (-4.3A)
None
None
 0.84A 4fvqA-2c1uA:
undetectable		 4fvqA-2c1uA:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G0U_F_ASWF101_1
(DNA TOPOISOMERASE
2-BETA)		 1jmz AMINE DEHYDROGENASE
(Pseudomonas
putida) 		4 / 6 ARG A 108
GLY A  36
ALA A  81
GLN A  30
 HEC  A1001 (-3.0A)
None
None
HEC  A1002 (-3.2A)
 1.13A 4g0uA-1jmzA:
undetectable		 4g0uA-1jmzA:
20.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GKH_A_KANA301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 11 ASN A 305
CYH A 306
ASP A 302
SER A 298
HIS A 297
 EDO  A 820 ( 3.1A)
HEC  A 805 (-1.7A)
None
HEC  A 805 ( 4.5A)
HEC  A 805 (-3.2A)
 1.47A 4gkhA-4lm8A:
0.3
4gkhB-4lm8A:
1.6		 4gkhA-4lm8A:
16.91
4gkhB-4lm8A:
16.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4GKI_I_KANI301_1
(AMINOGLYCOSIDE
3'-PHOSPHOTRANSFERAS
E APHA1-IAB)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 11 ASN A 305
CYH A 306
ASP A 302
SER A 298
HIS A 297
 EDO  A 820 ( 3.1A)
HEC  A 805 (-1.7A)
None
HEC  A 805 ( 4.5A)
HEC  A 805 (-3.2A)
 1.49A 4gkiI-4lm8A:
0.2
4gkiJ-4lm8A:
0.0		 4gkiI-4lm8A:
16.91
4gkiJ-4lm8A:
16.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4I1R_A_LZUA801_1
(MUCOSA-ASSOCIATED
LYMPHOID TISSUE
LYMPHOMA
TRANSLOCATION
PROTEIN 1)		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		5 / 12 VAL A 112
VAL A  94
GLU A  20
PHE A  21
LEU A  24
 None
None
None
HEC  A 131 ( 4.0A)
None
 0.98A 4i1rA-1gqaA:
undetectable		 4i1rA-1gqaA:
16.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4IIL_A_RBFA401_2
(MEMBRANE LIPOPROTEIN
TPN38(B))		 2jxm CYTOCHROME F
(Prochlorothrix
hollandica) 		4 / 8 VAL B  51
ASN B 155
GLN B  59
MET B 128
 None
HEC  B 250 ( 4.7A)
HEC  B 250 (-4.1A)
None
 1.09A 4iilA-2jxmB:
undetectable		 4iilA-2jxmB:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K50_A_ACTA505_0
(RNA POLYMERASE
3D-POL)		 2rf7 CYTOCHROME C-552
(Escherichia
coli) 		3 / 3 CYH A 314
ASN A 309
LYS A 322
 HEC  A   5 (-1.6A)
EDO  A 480 (-4.7A)
EDO  A 480 (-3.1A)
 1.44A 4k50A-2rf7A:
undetectable		 4k50A-2rf7A:
21.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K50_I_ACTI504_0
(RNA POLYMERASE
3D-POL)		 5guw NITRIC OXIDE
REDUCTASE SUBUNIT C
(Pseudomonas
aeruginosa) 		3 / 3 VAL A  81
GLY A  83
LYS A 144
 HEC  A 201 (-4.7A)
None
None
 0.75A 4k50I-5guwA:
undetectable		 4k50I-5guwA:
15.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K5J_B_H4BB502_1
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		4 / 7 PHE A  79
GLU A  71
SER A  74
TRP A  73
 HEC  A 201 (-4.4A)
None
None
None
 1.26A 4k5jA-5jt4A:
undetectable
4k5jB-5jt4A:
undetectable		 4k5jA-5jt4A:
14.38
4k5jB-5jt4A:
14.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KEB_B_FOLB202_0
(DIHYDROFOLATE
REDUCTASE)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 12 ILE A 377
ALA A 537
LEU A 521
THR A 337
ILE A 335
 HEC  A 807 ( 4.4A)
None
None
None
None
 1.08A 4kebB-4lm8A:
undetectable		 4kebB-4lm8A:
13.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KHP_A_PARA1606_1
(16S RIBOSOMAL RNA
30S RIBOSOMAL
PROTEIN S9
30S RIBOSOMAL
PROTEIN S10)		 2bh5 CYTOCHROME C-550
(Paracoccus
versutus) 		3 / 3 TYR X  55
ARG X  45
SER X  49
 HEC  X1123 (-4.5A)
HEC  X1123 (-4.0A)
None
 0.82A 4khpI-2bh5X:
undetectable
4khpJ-2bh5X:
undetectable		 4khpI-2bh5X:
22.46
4khpJ-2bh5X:
19.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KIC_B_SAMB401_0
(METHYLTRANSFERASE
MPPJ)		 1e2z CYTOCHROME F
(Chlamydomonas
reinhardtii) 		5 / 12 ILE A  19
CYH A  21
GLY A 238
ILE A  33
ALA A 240
 None
HEC  A 900 (-1.8A)
None
None
None
 1.11A 4kicB-1e2zA:
undetectable		 4kicB-1e2zA:
25.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4L39_A_SALA602_1
(4-SUBSTITUTED
BENZOATES-GLUTAMATE
LIGASE GH3.12)		 1e2z CYTOCHROME F
(Chlamydomonas
reinhardtii) 		4 / 6 LEU A 100
TYR A 102
ILE A  49
GLY A  72
 None
None
None
HEC  A 900 (-3.9A)
 1.02A 4l39A-1e2zA:
undetectable		 4l39A-1e2zA:
17.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LF7_A_PARA1817_1
(16S RRNA
RIBOSOMAL PROTEIN S9
RIBOSOMAL PROTEIN
S10)		 2bh5 CYTOCHROME C-550
(Paracoccus
versutus) 		3 / 3 TYR X  55
ARG X  45
SER X  49
 HEC  X1123 (-4.5A)
HEC  X1123 (-4.0A)
None
 0.75A 4lf7I-2bh5X:
undetectable
4lf7J-2bh5X:
undetectable		 4lf7I-2bh5X:
23.74
4lf7J-2bh5X:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LF8_A_PARA1817_1
(16S RRNA
RIBOSOMAL PROTEIN S9
RIBOSOMAL PROTEIN
S10)		 2bh5 CYTOCHROME C-550
(Paracoccus
versutus) 		3 / 3 TYR X  55
ARG X  45
SER X  49
 HEC  X1123 (-4.5A)
HEC  X1123 (-4.0A)
None
 0.75A 4lf8I-2bh5X:
undetectable
4lf8J-2bh5X:
undetectable		 4lf8I-2bh5X:
23.74
4lf8J-2bh5X:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4M6K_A_FOLA201_0
(DIHYDROFOLATE
REDUCTASE)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 12 ILE A 377
ALA A 537
LEU A 521
THR A 337
ILE A 335
 HEC  A 807 ( 4.4A)
None
None
None
None
 1.08A 4m6kA-4lm8A:
undetectable		 4m6kA-4lm8A:
13.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MJW_A_ACTA603_0
(CHOLINE OXIDASE)		 1z1n SIXTEEN HEME
CYTOCHROME
(Desulfovibrio
gigas) 		3 / 3 ARG X 196
HIS X 200
SER X 194
 HEC  X 601 ( 3.3A)
HEC  X 607 ( 3.3A)
None
 0.85A 4mjwA-1z1nX:
undetectable
4mjwB-1z1nX:
undetectable		 4mjwA-1z1nX:
21.99
4mjwB-1z1nX:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MJW_B_ACTB603_0
(CHOLINE OXIDASE)		 1z1n SIXTEEN HEME
CYTOCHROME
(Desulfovibrio
gigas) 		3 / 3 SER X 194
ARG X 196
HIS X 200
 None
HEC  X 601 ( 3.3A)
HEC  X 607 ( 3.3A)
 0.84A 4mjwA-1z1nX:
undetectable
4mjwB-1z1nX:
undetectable		 4mjwA-1z1nX:
21.99
4mjwB-1z1nX:
21.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MUB_A_OAQA302_0
(SULFOTRANSFERASE)		 2c1u DI-HAEM CYTOCHROME C
PEROXIDASE
(Paracoccus
pantotrophus) 		5 / 12 LEU A 264
VAL A 286
GLY A 245
PHE A 274
THR A 244
 HEC  A 402 (-4.8A)
HEC  A 402 ( 4.2A)
None
HEC  A 402 (-4.3A)
None
 1.36A 4mubA-2c1uA:
undetectable		 4mubA-2c1uA:
21.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MWV_A_BCZA513_0
(NEURAMINIDASE)		 1jmz AMINE DEHYDROGENASE
AMINE DEHYDROGENASE
(Pseudomonas
putida;
Pseudomonas
putida) 		5 / 12 GLU A 134
ARG B 148
ILE A 147
ARG A 142
ARG A 102
 None
None
None
None
HEC  A1001 ( 3.9A)
 1.46A 4mwvA-1jmzA:
undetectable		 4mwvA-1jmzA:
19.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NJV_A_RITA500_2
(PROTEASE)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		5 / 11 GLY A 225
GLY A 230
PRO A 135
THR A 134
ILE A 132
 None
HEC  A 606 ( 3.9A)
HEC  A 605 ( 4.8A)
None
HEC  A 602 ( 4.6A)
 0.99A 4njvB-4qo5A:
undetectable		 4njvB-4qo5A:
12.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NJV_D_RITD500_1
(PROTEASE)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		5 / 11 GLY A 225
GLY A 230
PRO A 135
THR A 134
ILE A 132
 None
HEC  A 606 ( 3.9A)
HEC  A 605 ( 4.8A)
None
HEC  A 602 ( 4.6A)
 0.94A 4njvC-4qo5A:
undetectable		 4njvC-4qo5A:
12.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4O5F_A_PAUA301_0
(TYPE III
PANTOTHENATE KINASE)		 2c1u DI-HAEM CYTOCHROME C
PEROXIDASE
(Paracoccus
pantotrophus) 		5 / 12 ASN A 103
LEU A 313
ARG A 265
ILE A  21
THR A 179
 HEC  A 401 (-4.0A)
None
None
None
None
 1.29A 4o5fA-2c1uA:
undetectable
4o5fB-2c1uA:
undetectable		 4o5fA-2c1uA:
22.97
4o5fB-2c1uA:
22.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4O5F_A_PAUA301_0
(TYPE III
PANTOTHENATE KINASE)		 2vhd CYTOCHROME C551
PEROXIDASE
(Pseudomonas
aeruginosa) 		5 / 12 ASN A  89
LEU A 299
ARG A 251
ILE A  14
THR A 165
 HEC  A 401 ( 4.9A)
None
None
None
None
 1.31A 4o5fA-2vhdA:
undetectable
4o5fB-2vhdA:
undetectable		 4o5fA-2vhdA:
22.85
4o5fB-2vhdA:
22.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4O8F_B_BRLB501_2
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 1h29 HIGH-MOLECULAR-WEIGH
T CYTOCHROME C
(Desulfovibrio
vulgaris) 		4 / 6 PHE A 368
GLY A 521
ILE A 528
LEU A 456
 HEC  A1114 (-4.9A)
None
HEC  A1115 ( 4.5A)
HEC  A1111 ( 4.3A)
 0.69A 4o8fB-1h29A:
0.0		 4o8fB-1h29A:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OKT_A_198A1001_1
(ANDROGEN RECEPTOR)		 1ql4 CYTOCHROME C552
(Paracoccus
denitrificans) 		5 / 12 LEU A  30
GLY A  32
VAL A  38
MET A  50
ILE A  93
 HEC  A 101 ( 4.6A)
None
HEC  A 101 ( 4.1A)
HEC  A 101 (-4.4A)
None
 1.29A 4oktA-1ql4A:
undetectable		 4oktA-1ql4A:
19.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4OLF_A_HFGA802_0
(PROLINE--TRNA LIGASE)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		5 / 12 VAL A 221
PRO A 131
HIS A 250
THR A  48
GLY A 106
 HEC  A 601 (-3.9A)
HEC  A 601 ( 4.1A)
HEC  A 602 (-3.3A)
None
HEC  A 602 (-4.2A)
 1.49A 4olfA-4qo5A:
undetectable		 4olfA-4qo5A:
21.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4P3Q_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 2c1d SOXA
SOXX
(Paracoccus
denitrificans;
Paracoccus
pantotrophus) 		4 / 5 LEU A 223
ARG A 247
ARG A  68
THR B  78
 HEC  A1292 (-4.9A)
HEC  A1292 (-3.4A)
HEC  A1292 (-3.1A)
None
 1.46A 4p3qA-2c1dA:
undetectable		 4p3qA-2c1dA:
18.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4QVV_K_BO2K301_1
(PROTEASOME SUBUNIT
BETA TYPE-5
PROTEASOME SUBUNIT
BETA TYPE-6)		 3ufk UNDA
(Shewanella
sp.
HRCR_06) 		4 / 8 THR A 817
GLY A 806
GLY A 807
VAL A 808
 None
None
HEC  A 911 ( 4.0A)
None
 0.75A 4qvvK-3ufkA:
undetectable
4qvvL-3ufkA:
undetectable		 4qvvK-3ufkA:
12.90
4qvvL-3ufkA:
14.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4R82_A_ACTA205_0
(OXIDOREDUCTASE)		 5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCON1
CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT II
(Pseudomonas
stutzeri;
Pseudomonas
stutzeri) 		4 / 5 SER A  52
GLY A  54
ARG A  55
GLU B  63
 None
HEC  B 301 ( 4.0A)
None
None
 1.07A 4r82A-5djqA:
undetectable
4r82B-5djqA:
undetectable		 4r82A-5djqA:
18.74
4r82B-5djqA:
18.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RP8_C_ASCC501_0
(ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		5 / 12 LEU A 194
ILE A  21
HIS A 234
ILE A 193
ILE A 284
 HEC  A1001 ( 3.7A)
SO4  A 534 ( 3.9A)
HEC  A1002 (-3.1A)
HEC  A1002 (-4.1A)
None
 1.03A 4rp8C-3ttbA:
2.8		 4rp8C-3ttbA:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RZV_A_032A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 3pmq DECAHEME CYTOCHROME
C MTRF
(Shewanella
oneidensis) 		4 / 5 ILE A 468
VAL A 467
CYH A 546
HIS A 527
 HEC  A 675 ( 4.2A)
HEC  A 677 (-4.4A)
HEC  A 677 (-1.8A)
HEC  A 675 ( 3.0A)
 0.90A 4rzvA-3pmqA:
undetectable		 4rzvA-3pmqA:
16.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RZV_A_032A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 3ufk UNDA
(Shewanella
sp.
HRCR_06) 		4 / 5 ILE A 430
VAL A 433
PHE A 439
CYH A 386
 HEC  A 904 ( 3.9A)
HEC  A 904 ( 3.9A)
HEC  A 905 (-4.5A)
HEC  A 904 (-1.8A)
 1.23A 4rzvA-3ufkA:
undetectable		 4rzvA-3ufkA:
14.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4RZV_A_032A801_2
(SERINE/THREONINE-PRO
TEIN KINASE B-RAF)		 3ufk UNDA
(Shewanella
sp.
HRCR_06) 		4 / 5 ILE A 648
VAL A 647
CYH A 751
HIS A 728
 HEC  A 906 ( 3.8A)
HEC  A 909 (-4.6A)
HEC  A 909 (-1.9A)
HEC  A 906 ( 3.1A)
 1.01A 4rzvA-3ufkA:
undetectable		 4rzvA-3ufkA:
14.58
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TWD_C_377C401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 5c2w HYPOTHETICAL (DI
HEME) PROTEIN
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 6 GLU C 219
TYR C 349
LEU C 350
PHE C 218
 None
None
HEC  C 405 ( 4.9A)
None
 1.23A 4twdB-5c2wC:
undetectable
4twdC-5c2wC:
undetectable		 4twdB-5c2wC:
23.75
4twdC-5c2wC:
23.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TWD_E_377E401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 5c2w HYPOTHETICAL (DI
HEME) PROTEIN
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 6 GLU C 219
TYR C 349
LEU C 350
PHE C 218
 None
None
HEC  C 405 ( 4.9A)
None
 1.19A 4twdD-5c2wC:
undetectable
4twdE-5c2wC:
undetectable		 4twdD-5c2wC:
23.75
4twdE-5c2wC:
23.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TWD_G_377G401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 5c2w HYPOTHETICAL (DI
HEME) PROTEIN
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 6 GLU C 219
TYR C 349
LEU C 350
PHE C 218
 None
None
HEC  C 405 ( 4.9A)
None
 1.26A 4twdF-5c2wC:
undetectable
4twdG-5c2wC:
undetectable		 4twdF-5c2wC:
23.75
4twdG-5c2wC:
23.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4TWD_J_377J401_1
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)		 5c2w HYPOTHETICAL (DI
HEME) PROTEIN
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 6 GLU C 219
TYR C 349
LEU C 350
PHE C 218
 None
None
HEC  C 405 ( 4.9A)
None
 1.16A 4twdI-5c2wC:
undetectable
4twdJ-5c2wC:
undetectable		 4twdI-5c2wC:
23.75
4twdJ-5c2wC:
23.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4U9U_B_ACTB1502_0
(NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT F)		 5c2v HYDRAZINE SYNTHASE
ALPHA SUBUNIT
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 5 ARG A 277
GLY A 282
ALA A 273
GLY A 280
 HEC  A 905 (-3.8A)
None
None
None
 0.97A 4u9uB-5c2vA:
undetectable		 4u9uB-5c2vA:
16.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4V32_C_EF2C151_1
(CEREBLON ISOFORM 4)		 3s7w EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
nitratireducens) 		4 / 7 ASN A 181
PRO A 182
PHE A 217
PHE A 137
 HEC  A1004 ( 4.7A)
None
None
None
 1.46A 4v32C-3s7wA:
undetectable		 4v32C-3s7wA:
12.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4WOZ_B_MN9B401_0
(N-ACETYLNEURAMINATE
LYASE)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		4 / 6 THR A  61
LEU A 194
ASP A 195
TYR A 228
 SO4  A 533 (-3.8A)
HEC  A1001 ( 3.7A)
None
HEC  A1002 (-3.6A)
 1.02A 4wozA-3ttbA:
undetectable
4wozB-3ttbA:
undetectable		 4wozA-3ttbA:
20.04
4wozB-3ttbA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4WOZ_F_MN9F401_0
(N-ACETYLNEURAMINATE
LYASE)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		4 / 5 LEU A 194
ASP A 195
TYR A 228
THR A  61
 HEC  A1001 ( 3.7A)
None
HEC  A1002 (-3.6A)
SO4  A 533 (-3.8A)
 0.97A 4wozF-3ttbA:
undetectable
4wozH-3ttbA:
undetectable		 4wozF-3ttbA:
20.04
4wozH-3ttbA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XP3_A_DX4A401_0
(MITOGEN-ACTIVATED
PROTEIN KINASE 1)		 2zzs CYTOCHROME C554
(Vibrio
parahaemolyticus) 		4 / 6 ALA A  31
GLN A  28
LEU A  95
LEU A 102
 None
None
HEC  A 220 ( 3.8A)
None
 1.22A 4xp3A-2zzsA:
undetectable		 4xp3A-2zzsA:
14.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XP4_A_COCA706_1
(DOPAMINE TRANSPORTER)		 2c1d SOXA
(Paracoccus
denitrificans) 		5 / 11 ALA A 214
VAL A 274
TYR A 195
GLY A  64
GLY A 278
 None
None
None
HEC  A1292 (-3.4A)
None
 1.09A 4xp4A-2c1dA:
undetectable		 4xp4A-2c1dA:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XQG_A_AG2A505_1
(HOMOSPERMIDINE
SYNTHASE)		 5c2w HYPOTHETICAL (DI
HEME) PROTEIN
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 8 ARG C 143
ASP C 168
PHE C 171
ASP C 121
 HEC  C 404 (-4.2A)
HEC  C 404 (-4.1A)
None
None
 1.14A 4xqgA-5c2wC:
undetectable		 4xqgA-5c2wC:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4XQG_B_AG2B505_1
(HOMOSPERMIDINE
SYNTHASE)		 5c2w HYPOTHETICAL (DI
HEME) PROTEIN
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 8 ARG C 143
ASP C 168
PHE C 171
ASP C 121
 HEC  C 404 (-4.2A)
HEC  C 404 (-4.1A)
None
None
 1.13A 4xqgB-5c2wC:
undetectable		 4xqgB-5c2wC:
19.42
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4YHA_E_MZME303_1
(ALPHA-CARBONIC
ANHYDRASE)		 1i8o CYTOCHROME C2
(Rhodopseudomonas
palustris) 		5 / 12 VAL A 107
VAL A 106
LEU A  67
ALA A  68
PRO A  70
 None
HEC  A 115 ( 4.9A)
HEC  A 115 (-4.6A)
None
None
 1.19A 4yhaE-1i8oA:
undetectable		 4yhaE-1i8oA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZE1_A_X2NA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 4aal CYTOCHROME C551
PEROXIDASE
(Geobacter
sulfurreducens) 		4 / 5 VAL A 135
ILE A  36
PRO A 103
THR A 231
 None
None
HEC  A 423 (-4.2A)
None
 1.33A 4ze1A-4aalA:
undetectable		 4ze1A-4aalA:
22.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZGF_A_BEZA210_0
(UNCHARACTERIZED
PROTEIN)		 2vhd CYTOCHROME C551
PEROXIDASE
(Pseudomonas
aeruginosa) 		4 / 4 VAL A  83
ALA A  86
ASN A  89
GLN A  92
 HEC  A 401 ( 4.8A)
HEC  A 401 ( 4.3A)
HEC  A 401 ( 4.9A)
HEC  A 401 (-4.5A)
 1.18A 4zgfA-2vhdA:
undetectable		 4zgfA-2vhdA:
19.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ZPH_A_PRLA501_0
(ARYL HYDROCARBON
RECEPTOR NUCLEAR
TRANSLOCATOR
ENDOTHELIAL PAS
DOMAIN-CONTAINING
PROTEIN 1)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		4 / 7 VAL A 321
TRP A 301
LEU A 319
SER A 318
 None
None
HEC  A 605 (-4.8A)
HEC  A 605 (-2.7A)
 1.02A 4zphA-4qo5A:
0.9
4zphB-4qo5A:
undetectable		 4zphA-4qo5A:
20.31
4zphB-4qo5A:
21.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A06_A_SORA1343_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		4 / 6 ASP A  65
HIS A 250
ARG A 249
ILE A  62
 None
HEC  A 602 (-3.3A)
HEC  A 602 ( 3.9A)
HEC  A 602 (-4.1A)
 1.17A 5a06A-4qo5A:
undetectable		 5a06A-4qo5A:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A06_B_SORB1343_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		4 / 5 ASP A  65
HIS A 250
ARG A 249
ILE A  62
 None
HEC  A 602 (-3.3A)
HEC  A 602 ( 3.9A)
HEC  A 602 (-4.1A)
 1.19A 5a06B-4qo5A:
undetectable		 5a06B-4qo5A:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A06_D_SORD1341_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 5lo9 CYTOCHROME C
(Marichromatium
purpuratum) 		4 / 6 CYH A  21
GLY A  30
GLY A  29
ASP A  28
 HEC  A1001 (-1.7A)
None
None
None
 0.90A 5a06D-5lo9A:
undetectable		 5a06D-5lo9A:
22.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A06_D_SORD1344_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		4 / 5 ASP A  65
HIS A 250
ARG A 249
ILE A  62
 None
HEC  A 602 (-3.3A)
HEC  A 602 ( 3.9A)
HEC  A 602 (-4.1A)
 1.19A 5a06D-4qo5A:
undetectable		 5a06D-4qo5A:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5A06_F_SORF1344_0
(ALDOSE-ALDOSE
OXIDOREDUCTASE)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		4 / 5 ASP A  65
HIS A 250
ARG A 249
ILE A  62
 None
HEC  A 602 (-3.3A)
HEC  A 602 ( 3.9A)
HEC  A 602 (-4.1A)
 1.17A 5a06F-4qo5A:
undetectable		 5a06F-4qo5A:
21.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ALB_L_TIQL1210_2
(MEDI2452 LIGHT CHAIN)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		4 / 8 TYR A 149
GLY A 241
ALA A 197
GLY A 200
 HEC  A 605 (-4.1A)
None
None
None
 0.85A 5albL-4qo5A:
undetectable		 5albL-4qo5A:
17.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AXD_A_RBVA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 3h1l MITOCHONDRIAL
CYTOCHROME C1, HEME
PROTEIN
(Gallus
gallus) 		3 / 3 THR D  55
HIS D  41
LEU D 190
 None
HEC  D 501 (-3.2A)
None
 0.77A 5axdA-3h1lD:
undetectable		 5axdA-3h1lD:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5AXD_C_RBVC502_2
(ADENOSYLHOMOCYSTEINA
SE)		 3h1l MITOCHONDRIAL
CYTOCHROME C1, HEME
PROTEIN
(Gallus
gallus) 		3 / 3 THR D  55
HIS D  41
LEU D 190
 None
HEC  D 501 (-3.2A)
None
 0.78A 5axdC-3h1lD:
undetectable		 5axdC-3h1lD:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BTI_E_LFXE101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
GGTCATGAATGACTATGCAC
GTAA)		 5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCON1
CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCOP1
CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT II
(Pseudomonas
stutzeri) 		4 / 5 SER C 144
ARG B 104
GLY B 106
THR A 339
 None
None
HEC  B 301 (-3.4A)
None
 0.96A 5btiA-5djqC:
undetectable
5btiB-5djqC:
undetectable		 5btiA-5djqC:
21.06
5btiB-5djqC:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5BTI_F_LFXF101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
DNA SUBSTRATE 24-MER
TTACGTGCATAGTCATTCAT
GACC)		 5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCON1
CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCOP1
CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT II
(Pseudomonas
stutzeri) 		4 / 5 SER C 144
ARG B 104
GLY B 106
THR A 339
 None
None
HEC  B 301 (-3.4A)
None
 1.04A 5btiC-5djqC:
undetectable
5btiD-5djqC:
undetectable		 5btiC-5djqC:
21.06
5btiD-5djqC:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5C0O_E_SAME301_0
(TRNA
(ADENINE(58)-N(1))-M
ETHYLTRANSFERASE
TRMI)		 6f0k QUINOL:CYTOCHROME C
OXIDOREDUCTASE
MONOHEME CYTOCHROME
SUBUNIT
(Rhodothermus
marinus) 		5 / 12 ALA E 138
PRO E 137
GLY E 126
ALA E 115
HIS E 118
 HEC  E 400 (-3.3A)
HEC  E 400 ( 4.9A)
None
None
HEC  E 400 (-3.2A)
 1.20A 5c0oE-6f0kE:
undetectable		 5c0oE-6f0kE:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CCM_A_SAMA504_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SMYD3)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		5 / 12 GLY A 376
ASN A 375
GLU A 373
ASN A 492
HIS A 383
 None
HEC  A1008 ( 4.0A)
None
None
HEC  A1007 ( 3.1A)
 1.37A 5ccmA-3ttbA:
undetectable		 5ccmA-3ttbA:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5CR1_A_T44A201_1
(TRANSTHYRETIN)		 2jxm CYTOCHROME F
(Prochlorothrix
hollandica) 		4 / 5 LEU B  75
ALA B  73
LEU B 115
VAL B  71
 None
None
None
HEC  B 250 (-4.1A)
 1.04A 5cr1A-2jxmB:
undetectable		 5cr1A-2jxmB:
21.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5D0Y_A_FOLA201_0
(CONSERVED
HYPOTHETICAL
MEMBRANE PROTEIN)		 3s7w EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
nitratireducens) 		5 / 12 SER A 487
PHE A 367
THR A 366
ASN A 293
VAL A 377
 None
HEC  A1007 (-4.3A)
None
None
HEC  A1008 ( 4.2A)
 1.45A 5d0yA-3s7wA:
undetectable		 5d0yA-3s7wA:
16.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5D0Y_A_FOLA201_0
(CONSERVED
HYPOTHETICAL
MEMBRANE PROTEIN)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		5 / 12 SER A 487
PHE A 367
THR A 366
ASN A 293
VAL A 377
 None
HEC  A1007 (-4.3A)
None
HEC  A1007 ( 4.8A)
HEC  A1008 (-4.3A)
 1.41A 5d0yA-3ttbA:
undetectable		 5d0yA-3ttbA:
15.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5D0Y_B_FOLB201_0
(CONSERVED
HYPOTHETICAL
MEMBRANE PROTEIN)		 3s7w EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
nitratireducens) 		5 / 12 SER A 487
PHE A 367
THR A 366
ASN A 293
VAL A 377
 None
HEC  A1007 (-4.3A)
None
None
HEC  A1008 ( 4.2A)
 1.43A 5d0yB-3s7wA:
undetectable		 5d0yB-3s7wA:
16.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5D0Y_B_FOLB201_0
(CONSERVED
HYPOTHETICAL
MEMBRANE PROTEIN)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		5 / 12 SER A 487
PHE A 367
THR A 366
ASN A 293
VAL A 377
 None
HEC  A1007 (-4.3A)
None
HEC  A1007 ( 4.8A)
HEC  A1008 (-4.3A)
 1.39A 5d0yB-3ttbA:
undetectable		 5d0yB-3ttbA:
15.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5D4N_A_ACTA202_0
(NITROGEN REGULATORY
PROTEIN P-II)		 5lo9 CYTOCHROME C
(Marichromatium
purpuratum) 		4 / 4 VAL A  80
GLY A   5
ARG A   4
VAL A  75
 HEC  A1001 (-4.4A)
None
None
None
 1.33A 5d4nA-5lo9A:
undetectable
5d4nB-5lo9A:
undetectable		 5d4nA-5lo9A:
12.89
5d4nB-5lo9A:
12.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5DB5_A_CYSA503_0
(CYSTEINE DESULFURASE)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
ALTERNATIVE COMPLEX
III SUBUNIT E
(Flavobacterium
johnsoniae;
Flavobacterium
johnsoniae) 		4 / 8 ALA E 154
HIS E 158
ASN A 296
HIS E 112
 HEC  E 201 ( 3.8A)
HEC  E 201 ( 4.2A)
None
HEC  E 201 (-3.2A)
 1.17A 5db5A-6btmE:
undetectable
5db5B-6btmE:
undetectable		 5db5A-6btmE:
undetectable
5db5B-6btmE:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5DXE_A_ESTA1000_1
(ESTROGEN RECEPTOR)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		4 / 8 MET A 209
GLU A 221
LEU A 155
HIS A 164
 HEC  A1002 (-2.2A)
None
None
HEC  A1002 (-3.2A)
 0.95A 5dxeA-4wqeA:
undetectable		 5dxeA-4wqeA:
21.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5E4D_B_BEZB202_0
(HYDROXYNITRILE LYASE)		 1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE
(Comamonas
testosteroni) 		4 / 7 VAL A 120
THR A 167
ARG A  67
LEU A 547
 None
PQQ  A1800 (-2.9A)
HEC  A 802 (-4.2A)
None
 0.92A 5e4dA-1kb0A:
0.0
5e4dB-1kb0A:
0.0		 5e4dA-1kb0A:
15.20
5e4dB-1kb0A:
15.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ECO_A_LEUA602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		4 / 6 THR A 244
ALA A 245
TYR A 149
HIS A 229
 HEC  A 602 ( 2.7A)
HEC  A 606 (-3.8A)
HEC  A 605 (-4.1A)
HEC  A 602 (-4.3A)
 0.88A 5ecoA-4qo5A:
undetectable		 5ecoA-4qo5A:
23.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HQA_A_ACRA705_2
(ALPHA-GLUCOSIDASE)		 3s7w EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
nitratireducens) 		4 / 8 TRP A 329
GLU A 365
HIS A 300
THR A 289
 None
None
HEC  A1006 (-3.2A)
None
 1.47A 5hqaA-3s7wA:
undetectable		 5hqaA-3s7wA:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HRQ_G_IPHG101_0
(INSULIN A-CHAIN
INSULIN B-CHAIN)		 3o5a PERIPLASMIC NITRATE
REDUCTASE
DIHEME CYTOCHROME C
NAPB
(Cupriavidus
necator;
Cupriavidus
necator) 		4 / 6 LEU A 711
CYH B 101
HIS A 698
LEU A 696
 None
HEC  B1129 (-2.1A)
None
None
 1.41A 5hrqD-3o5aA:
undetectable
5hrqG-3o5aA:
undetectable
5hrqH-3o5aA:
undetectable		 5hrqD-3o5aA:
3.25
5hrqG-3o5aA:
3.88
5hrqH-3o5aA:
3.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5HWA_A_GCSA302_1
(CHITOSANASE)		 3ufk UNDA
(Shewanella
sp.
HRCR_06) 		4 / 7 THR A 296
ASP A 293
GLY A 321
TYR A 324
 None
CA  A 912 ( 3.1A)
None
HEC  A 902 ( 4.2A)
 0.90A 5hwaA-3ufkA:
undetectable		 5hwaA-3ufkA:
16.59
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ICX_F_SC2F1_1
(CETUXIMAB FAB LIGHT
CHAIN
MEDITOPE)		 5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCOP1
(Pseudomonas
stutzeri) 		3 / 3 VAL C 201
GLN C 231
CYH C 233
 HEC  C 401 ( 4.5A)
None
HEC  C 401 (-1.7A)
 0.84A 5icxC-5djqC:
undetectable
5icxF-5djqC:
undetectable		 5icxC-5djqC:
18.44
5icxF-5djqC:
5.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IEN_A_VDYA201_2
(CDL2.2)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		5 / 12 PRO A 258
LEU A 364
VAL A 240
LEU A 287
GLY A 285
 None
HEC  A1007 (-4.1A)
None
None
None
 1.18A 5ienA-3ttbA:
undetectable		 5ienA-3ttbA:
14.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IEO_A_VDYA206_2
(CDL2.3A)		 5nmi CYTOCHROME C1, HEME
PROTEIN,
MITOCHONDRIAL
(Bos
taurus) 		4 / 8 ILE D 164
LEU D 113
ILE D 116
LEU D 169
 None
HEC  D 501 ( 4.9A)
HEC  D 501 (-4.3A)
None
 0.90A 5ieoA-5nmiD:
undetectable		 5ieoA-5nmiD:
17.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IEO_A_VDYA206_2
(CDL2.3A)		 5okd CYTOCHROME C1, HEME
PROTEIN,
MITOCHONDRIAL
(Bos
taurus) 		4 / 8 ILE D 164
LEU D 113
ILE D 116
LEU D 169
 None
None
HEC  D 501 (-4.2A)
None
 0.88A 5ieoA-5okdD:
undetectable		 5ieoA-5okdD:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IKT_B_TLFB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 3vrd FLAVOCYTOCHROME C
FLAVIN SUBUNIT
(Thermochromatium
tepidum) 		3 / 3 TYR B 338
TYR B 353
SER B 307
 HEC  A 201 ( 4.8A)
None
None
 0.94A 5iktB-3vrdB:
undetectable		 5iktB-3vrdB:
23.10
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5IWU_A_ERYA404_1
(MACROLIDE
2'-PHOSPHOTRANSFERAS
E II)		 5nmi CYTOCHROME B
CYTOCHROME C1, HEME
PROTEIN,
MITOCHONDRIAL
(Bos
taurus;
Bos
taurus) 		4 / 6 GLY D 155
ASP C 254
ILE D 116
TYR D 126
 None
None
HEC  D 501 (-4.3A)
HEC  D 501 (-4.2A)
 1.09A 5iwuA-5nmiD:
undetectable		 5iwuA-5nmiD:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5JDC_D_6JPD302_1
(PTERIDINE REDUCTASE)		 3pmq DECAHEME CYTOCHROME
C MTRF
(Shewanella
oneidensis) 		5 / 11 SER A 100
VAL A 215
LEU A  89
PRO A  91
TRP A 175
 HEC  A 672 ( 4.3A)
None
None
None
None
 1.46A 5jdcA-3pmqA:
undetectable
5jdcD-3pmqA:
undetectable		 5jdcA-3pmqA:
17.41
5jdcD-3pmqA:
17.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5JLC_A_1YNA602_1
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 4y5r METHYLAMINE
UTILIZATION PROTEIN
MAUG
(Paracoccus
denitrificans) 		5 / 12 ALA A  73
PHE A 185
PHE A 345
PHE A 171
THR A 219
 HEC  A 402 ( 4.6A)
None
None
None
None
 1.30A 5jlcA-4y5rA:
undetectable		 5jlcA-4y5rA:
21.13
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JLI_A_ASCA202_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		5 / 5 ALA A  18
GLY A 116
CYH A 119
LYS A 120
HIS A 123
 HEC  A 131 ( 3.8A)
None
HEC  A 131 (-1.8A)
None
HEC  A 131 (-3.1A)
 0.65A 5jliA-1gqaA:
17.8		 5jliA-1gqaA:
39.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JLI_A_ASCA202_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 5 GLY A 117
CYH A 119
LYS A 120
HIS A 123
 None
HEC  A 131 (-1.8A)
None
HEC  A 131 (-3.1A)
 0.95A 5jliA-1gqaA:
17.8		 5jliA-1gqaA:
39.10
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JLI_A_ASCA202_0
(CYTOCHROME C')		 3vrc CYTOCHROME C'
(Thermochromatium
tepidum) 		4 / 5 ALA A  20
GLY A 118
CYH A 121
HIS A 125
 HEC  A 200 ( 3.8A)
None
HEC  A 200 (-1.9A)
HEC  A 200 (-3.3A)
 0.25A 5jliA-3vrcA:
17.3		 5jliA-3vrcA:
30.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JLI_A_ASCA202_0
(CYTOCHROME C')		 4cx9 CYTOCHROME C, CLASS
II
(Shewanella
frigidimarina) 		4 / 5 ALA A  20
GLY A 115
CYH A 118
LYS A 119
 HEC  A1129 (-3.5A)
None
HEC  A1129 (-1.9A)
None
 0.42A 5jliA-4cx9A:
19.9		 5jliA-4cx9A:
41.86
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JLI_A_ASCA202_0
(CYTOCHROME C')		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		4 / 5 ALA A  16
CYH A 116
LYS A 117
HIS A 120
 HEC  A 201 (-3.4A)
HEC  A 201 (-1.9A)
None
HEC  A 201 (-3.2A)
 1.36A 5jliA-5jt4A:
25.2		 5jliA-5jt4A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JLI_A_ASCA202_0
(CYTOCHROME C')		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		5 / 5 ALA A  20
GLY A 113
CYH A 116
LYS A 117
HIS A 120
 ASC  A 202 ( 3.3A)
ASC  A 202 (-3.9A)
HEC  A 201 (-1.9A)
None
HEC  A 201 (-3.2A)
 0.17A 5jliA-5jt4A:
25.2		 5jliA-5jt4A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JRA_A_ASCA202_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 4 GLY A 116
CYH A 119
LYS A 120
HIS A 123
 None
HEC  A 131 (-1.8A)
None
HEC  A 131 (-3.1A)
 0.20A 5jraA-1gqaA:
17.5		 5jraA-1gqaA:
39.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JRA_A_ASCA202_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 4 GLY A 117
CYH A 119
LYS A 120
HIS A 123
 None
HEC  A 131 (-1.8A)
None
HEC  A 131 (-3.1A)
 1.01A 5jraA-1gqaA:
17.5		 5jraA-1gqaA:
39.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JRA_A_ASCA202_0
(CYTOCHROME C')		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		4 / 4 GLY A 113
CYH A 116
LYS A 117
HIS A 120
 ASC  A 202 (-3.9A)
HEC  A 201 (-1.9A)
None
HEC  A 201 (-3.2A)
 0.12A 5jraA-5jt4A:
24.6		 5jraA-5jt4A:
99.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JS5_A_ASCA202_0
(CYTOCHROME C')		 4cx9 CYTOCHROME C, CLASS
II
(Shewanella
frigidimarina) 		3 / 3 CYH A 118
LYS A 119
HIS A 122
 HEC  A1129 (-1.9A)
None
NO  A1130 (-4.8A)
 0.31A 5js5A-4cx9A:
19.8		 5js5A-4cx9A:
42.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JSL_A_ASCA202_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 4 ALA A  18
GLY A 116
CYH A 119
HIS A 123
 HEC  A 131 ( 3.8A)
None
HEC  A 131 (-1.8A)
HEC  A 131 (-3.1A)
 0.36A 5jslA-1gqaA:
17.4		 5jslA-1gqaA:
40.15
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JSL_A_ASCA202_0
(CYTOCHROME C')		 3vrc CYTOCHROME C'
(Thermochromatium
tepidum) 		4 / 4 ALA A  20
GLY A 118
CYH A 121
HIS A 125
 HEC  A 200 ( 3.8A)
None
HEC  A 200 (-1.9A)
HEC  A 200 (-3.3A)
 0.18A 5jslA-3vrcA:
17.5		 5jslA-3vrcA:
30.30
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JSL_A_ASCA202_0
(CYTOCHROME C')		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		4 / 4 ALA A  20
GLY A 113
CYH A 116
HIS A 120
 ASC  A 202 ( 3.3A)
ASC  A 202 (-3.9A)
HEC  A 201 (-1.9A)
HEC  A 201 (-3.2A)
 0.07A 5jslA-5jt4A:
25.0		 5jslA-5jt4A:
99.20
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JT4_A_ASCA202_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		5 / 5 ALA A  18
GLY A 116
CYH A 119
LYS A 120
HIS A 123
 HEC  A 131 ( 3.8A)
None
HEC  A 131 (-1.8A)
None
HEC  A 131 (-3.1A)
 0.76A 5jt4A-1gqaA:
17.4		 5jt4A-1gqaA:
39.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JT4_A_ASCA202_0
(CYTOCHROME C')		 1gqa CYTOCHROME C'
(Rhodobacter
sphaeroides) 		4 / 5 GLY A 117
CYH A 119
LYS A 120
HIS A 123
 None
HEC  A 131 (-1.8A)
None
HEC  A 131 (-3.1A)
 0.98A 5jt4A-1gqaA:
17.4		 5jt4A-1gqaA:
39.39
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JT4_A_ASCA202_0
(CYTOCHROME C')		 3vrc CYTOCHROME C'
(Thermochromatium
tepidum) 		4 / 5 ALA A  20
GLY A 118
CYH A 121
HIS A 125
 HEC  A 200 ( 3.8A)
None
HEC  A 200 (-1.9A)
HEC  A 200 (-3.3A)
 0.21A 5jt4A-3vrcA:
17.2		 5jt4A-3vrcA:
30.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JT4_A_ASCA202_0
(CYTOCHROME C')		 4cx9 CYTOCHROME C, CLASS
II
(Shewanella
frigidimarina) 		4 / 5 ALA A  20
GLY A 115
CYH A 118
LYS A 119
 HEC  A1129 (-3.5A)
None
HEC  A1129 (-1.9A)
None
 0.53A 5jt4A-4cx9A:
19.9		 5jt4A-4cx9A:
41.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JT4_A_ASCA202_0
(CYTOCHROME C')		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		4 / 5 ALA A  16
CYH A 116
LYS A 117
HIS A 120
 HEC  A 201 (-3.4A)
HEC  A 201 (-1.9A)
None
HEC  A 201 (-3.2A)
 1.44A 5jt4A-5jt4A:
26.1		 5jt4A-5jt4A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5JT4_A_ASCA202_0
(CYTOCHROME C')		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		5 / 5 ALA A  20
GLY A 113
CYH A 116
LYS A 117
HIS A 120
 ASC  A 202 ( 3.3A)
ASC  A 202 (-3.9A)
HEC  A 201 (-1.9A)
None
HEC  A 201 (-3.2A)
 0.02A 5jt4A-5jt4A:
26.1		 5jt4A-5jt4A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KOX_A_RFPA502_2
(PENTACHLOROPHENOL
4-MONOOXYGENASE)		 2p0b CYTOCHROME C-TYPE
PROTEIN NRFB
(Escherichia
coli) 		3 / 3 VAL A  81
ARG A 134
PRO A 103
 None
None
HEC  A 205 (-4.5A)
 0.75A 5koxA-2p0bA:
undetectable		 5koxA-2p0bA:
15.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KXI_A_NCTA402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 2yiu CYTOCHROME C1, HEME
PROTEIN
(Paracoccus
denitrificans) 		4 / 8 TYR B 221
THR B 234
CYH B  82
LEU B 214
 None
None
HEC  B 500 (-1.6A)
HEC  B 500 ( 4.5A)
 1.43A 5kxiA-2yiuB:
undetectable
5kxiB-2yiuB:
undetectable		 5kxiA-2yiuB:
19.54
5kxiB-2yiuB:
20.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5KXI_D_NCTD402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 2yiu CYTOCHROME C1, HEME
PROTEIN
(Paracoccus
denitrificans) 		4 / 8 TYR B 221
THR B 234
CYH B  82
LEU B 214
 None
None
HEC  B 500 (-1.6A)
HEC  B 500 ( 4.5A)
 1.36A 5kxiD-2yiuB:
undetectable
5kxiE-2yiuB:
undetectable		 5kxiD-2yiuB:
19.54
5kxiE-2yiuB:
20.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5LSU_B_SAMB1304_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE
NSD2)		 1gq1 CYTOCHROME CD1
NITRITE REDUCTASE
(Paracoccus
pantotrophus) 		3 / 3 ASN A  58
TYR A 126
CYH A  65
 None
None
HEC  A 601 (-1.8A)
 1.10A 5lsuB-1gq1A:
undetectable		 5lsuB-1gq1A:
17.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5M5C_B_TA1B502_1
(TUBULIN BETA-2B
CHAIN)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		5 / 12 ASP A 450
LEU A 682
ARG A 558
GLY A 653
LEU A 652
 None
None
HEC  A 808 (-4.2A)
None
HEC  A 809 ( 4.8A)
 1.21A 5m5cB-4lmhA:
undetectable		 5m5cB-4lmhA:
18.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5MRA_B_DM2B204_1
(SORCIN)		 1ogy DIHEME CYTOCHROME C
NAPB MOLECULE:
NITRATE REDUCTASE
(Rhodobacter
sphaeroides) 		4 / 6 THR B  78
ARG B  95
ASP B  82
GLY B  85
 None
HEC  B1129 (-4.2A)
None
None
 1.21A 5mraA-1ogyB:
undetectable
5mraB-1ogyB:
undetectable		 5mraA-1ogyB:
22.47
5mraB-1ogyB:
22.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5N9X_A_THRA601_0
(ADENYLATION DOMAIN)		 2bpn CYTOCHROME C3
(Desulfovibrio
vulgaris) 		4 / 7 ASP A  42
GLY A  50
GLY A  47
HIS A  52
 HEC  A 109 (-2.6A)
None
HEC  A 109 ( 4.7A)
HEC  A 109 (-3.1A)
 1.00A 5n9xA-2bpnA:
undetectable		 5n9xA-2bpnA:
10.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5NWU_A_ACAA18_1
(WTFP-TAG,GP41)		 3ttb EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
paradoxus) 		5 / 12 ALA A 244
ASN A 331
GLU A 365
LEU A 364
GLU A 373
 None
None
None
HEC  A1007 (-4.1A)
None
 0.97A 5nwuA-3ttbA:
undetectable		 5nwuA-3ttbA:
5.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OV9_A_CVIA608_0
(ACETYLCHOLINESTERASE)		 5c2v HYDRAZINE SYNTHASE
ALPHA SUBUNIT
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 7 THR A 777
LEU A 776
VAL A 746
TYR A 750
 None
HEC  A 906 (-4.2A)
None
None
 1.11A 5ov9A-5c2vA:
undetectable		 5ov9A-5c2vA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5OV9_B_CVIB602_0
(ACETYLCHOLINESTERASE)		 5c2v HYDRAZINE SYNTHASE
ALPHA SUBUNIT
(Candidatus
Kuenenia
stuttgartiensis) 		4 / 8 THR A 777
LEU A 776
VAL A 746
TYR A 750
 None
HEC  A 906 (-4.2A)
None
None
 1.09A 5ov9B-5c2vA:
undetectable		 5ov9B-5c2vA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5SXQ_A_NIZA808_1
(CATALASE-PEROXIDASE)		 1z1n SIXTEEN HEME
CYTOCHROME
(Desulfovibrio
gigas) 		4 / 8 VAL X 287
GLY X 339
GLN X 344
THR X 342
 HEC  X 608 ( 4.4A)
None
HEC  X 610 (-4.6A)
None
 0.87A 5sxqA-1z1nX:
undetectable		 5sxqA-1z1nX:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5SXT_A_NIZA807_1
(CATALASE-PEROXIDASE)		 1z1n SIXTEEN HEME
CYTOCHROME
(Desulfovibrio
gigas) 		4 / 8 VAL X 287
GLY X 339
GLN X 344
THR X 342
 HEC  X 608 ( 4.4A)
None
HEC  X 610 (-4.6A)
None
 0.87A 5sxtA-1z1nX:
undetectable		 5sxtA-1z1nX:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5SXT_B_NIZB808_1
(CATALASE-PEROXIDASE)		 1z1n SIXTEEN HEME
CYTOCHROME
(Desulfovibrio
gigas) 		4 / 8 VAL X 287
GLY X 339
GLN X 344
THR X 342
 HEC  X 608 ( 4.4A)
None
HEC  X 610 (-4.6A)
None
 0.89A 5sxtB-1z1nX:
undetectable		 5sxtB-1z1nX:
21.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TT3_A_EZLA303_1
(ALPHA-CARBONIC
ANHYDRASE)		 1i8o CYTOCHROME C2
(Rhodopseudomonas
palustris) 		5 / 10 VAL A 107
VAL A 106
LEU A  67
ALA A  68
PRO A  70
 None
HEC  A 115 ( 4.9A)
HEC  A 115 (-4.6A)
None
None
 1.31A 5tt3A-1i8oA:
undetectable		 5tt3A-1i8oA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TT3_C_EZLC303_1
(ALPHA-CARBONIC
ANHYDRASE)		 1i8o CYTOCHROME C2
(Rhodopseudomonas
palustris) 		5 / 10 VAL A 107
VAL A 106
LEU A  67
ALA A  68
PRO A  70
 None
HEC  A 115 ( 4.9A)
HEC  A 115 (-4.6A)
None
None
 1.23A 5tt3C-1i8oA:
undetectable		 5tt3C-1i8oA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5TZO_B_7V7B201_1
(ENDO-1,4-BETA-XYLANA
SE A)		 2jxm CYTOCHROME F
(Prochlorothrix
hollandica) 		5 / 12 LEU B  83
VAL B 104
ALA B  73
ALA B 117
GLY B 118
 None
None
None
None
HEC  B 250 ( 4.3A)
 1.03A 5tzoB-2jxmB:
undetectable		 5tzoB-2jxmB:
20.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UH6_C_RFPC1201_1
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA)		 3pmq DECAHEME CYTOCHROME
C MTRF
(Shewanella
oneidensis) 		5 / 12 GLN A 494
LEU A 497
GLN A 496
ASN A 470
HIS A 524
 None
None
HEC  A 677 (-3.7A)
None
HEC  A 677 (-3.3A)
 1.27A 5uh6C-3pmqA:
2.0		 5uh6C-3pmqA:
19.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UIG_A_EDTA501_0
(ADENOSINE RECEPTOR
A2A,SOLUBLE
CYTOCHROME
B562,ADENOSINE
RECEPTOR A2A)		 3vrc CYTOCHROME C'
(Thermochromatium
tepidum) 		4 / 6 ASN A  65
ARG A  72
ILE A   9
GLU A   6
 None
None
HEC  A 200 ( 4.7A)
None
 1.17A 5uigA-3vrcA:
5.3		 5uigA-3vrcA:
19.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UO7_A_H4BA802_1
(NITRIC OXIDE
SYNTHASE, BRAIN)		 4qo5 HYPOTHETICAL
MULTIHEME PROTEIN
(Ignicoccus
hospitalis) 		4 / 8 SER A 281
TRP A 278
PHE A 275
GLU A 280
 None
HEC  A 607 (-4.7A)
None
None
 1.31A 5uo7A-4qo5A:
undetectable
5uo7B-4qo5A:
undetectable		 5uo7A-4qo5A:
21.57
5uo7B-4qo5A:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UTU_F_ADNF503_2
(ADENOSYLHOMOCYSTEINA
SE)		 4fas HYDROXYLAMINE
OXIDOREDUCTASE
(Nitrosomonas
europaea) 		4 / 4 GLU A 179
THR A 322
GLU A 186
HIS A  38
 HEC  A 604 (-3.7A)
None
None
None
 1.24A 5utuF-4fasA:
0.0		 5utuF-4fasA:
21.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V5Z_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 1zzh CYTOCHROME C
PEROXIDASE
(Rhodobacter
capsulatus) 		3 / 3 GLY A 211
THR A  70
PRO A  84
 None
None
HEC  A 802 (-4.2A)
 0.63A 5v5zA-1zzhA:
undetectable		 5v5zA-1zzhA:
21.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V5Z_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2c1u DI-HAEM CYTOCHROME C
PEROXIDASE
(Paracoccus
pantotrophus) 		3 / 3 GLY A 222
THR A  81
PRO A  95
 None
None
HEC  A 401 (-4.3A)
 0.64A 5v5zA-2c1uA:
undetectable		 5v5zA-2c1uA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V5Z_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 2vhd CYTOCHROME C551
PEROXIDASE
(Pseudomonas
aeruginosa) 		3 / 3 GLY A 208
THR A  67
PRO A  81
 None
None
HEC  A 401 (-4.5A)
 0.64A 5v5zA-2vhdA:
undetectable		 5v5zA-2vhdA:
19.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V5Z_A_1YNA602_2
(LANOSTEROL 14-ALPHA
DEMETHYLASE)		 4aal CYTOCHROME C551
PEROXIDASE
(Geobacter
sulfurreducens) 		3 / 3 GLY A 230
THR A  89
PRO A 103
 None
None
HEC  A 423 (-4.2A)
 0.57A 5v5zA-4aalA:
undetectable		 5v5zA-4aalA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VKQ_A_PCFA1803_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		5 / 10 ILE A 306
ILE A 299
LEU A 135
HIS A 277
ILE A 276
 HEC  A 802 ( 4.4A)
None
None
HEC  A 801 ( 3.0A)
HEC  A 801 ( 4.3A)
 1.38A 5vkqA-4lmhA:
undetectable
5vkqD-4lmhA:
undetectable		 5vkqA-4lmhA:
18.57
5vkqD-4lmhA:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VKQ_B_PCFB1808_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		5 / 10 HIS A 277
ILE A 276
ILE A 306
ILE A 299
LEU A 135
 HEC  A 801 ( 3.0A)
HEC  A 801 ( 4.3A)
HEC  A 802 ( 4.4A)
None
None
 1.39A 5vkqA-4lmhA:
undetectable
5vkqB-4lmhA:
undetectable		 5vkqA-4lmhA:
18.57
5vkqB-4lmhA:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VKQ_D_PCFD1801_0
(NO MECHANORECEPTOR
POTENTIAL C ISOFORM
L)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		5 / 10 HIS A 277
ILE A 276
ILE A 306
ILE A 299
LEU A 135
 HEC  A 801 ( 3.0A)
HEC  A 801 ( 4.3A)
HEC  A 802 ( 4.4A)
None
None
 1.37A 5vkqC-4lmhA:
undetectable
5vkqD-4lmhA:
undetectable		 5vkqC-4lmhA:
18.57
5vkqD-4lmhA:
18.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VVN_B_H4BB502_1
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		4 / 7 PHE A  79
GLU A  71
SER A  74
TRP A  73
 HEC  A 201 (-4.4A)
None
None
None
 1.22A 5vvnA-5jt4A:
undetectable
5vvnB-5jt4A:
undetectable		 5vvnA-5jt4A:
14.38
5vvnB-5jt4A:
14.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WWS_A_SAMA501_0
(PUTATIVE
METHYLTRANSFERASE
NSUN6)		 3m97 CYTOCHROME C-552
(Paracoccus
denitrificans) 		5 / 12 CYH X  54
ALA X  56
GLY X  65
LEU X 123
LEU X 132
 HEC  X 141 (-1.8A)
None
None
HEC  X 141 ( 4.8A)
HEC  X 141 (-4.8A)
 1.17A 5wwsA-3m97X:
undetectable		 5wwsA-3m97X:
15.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X19_P_CHDP306_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 6 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.33A 5x19N-6btmA:
undetectable
5x19P-6btmA:
undetectable		 5x19N-6btmA:
undetectable
5x19P-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5X1F_P_CHDP305_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 7 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.36A 5x1fN-6btmA:
undetectable
5x1fP-6btmA:
undetectable		 5x1fN-6btmA:
undetectable
5x1fP-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5YCP_A_BRLA501_1
(PEROXISOME
PROLIFERATOR-ACTIVAT
ED RECEPTOR GAMMA)		 5c2v HYDRAZINE SYNTHASE
ALPHA SUBUNIT
(Candidatus
Kuenenia
stuttgartiensis) 		3 / 3 GLY A 585
VAL A 489
MET A 556
 CL  A 901 (-3.6A)
None
HEC  A 905 ( 3.8A)
 0.59A 5ycpA-5c2vA:
undetectable		 5ycpA-5c2vA:
7.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6A7P_B_9SCB601_0
(SERUM ALBUMIN)		 3ocd SOXX
(Starkeya
novella) 		5 / 12 VAL B 195
LEU B 199
ALA B 174
PHE B 181
LEU B 187
 HEC  B 401 ( 4.6A)
None
None
HEC  B 401 (-3.8A)
None
 1.22A 6a7pB-3ocdB:
undetectable		 6a7pB-3ocdB:
16.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6A7P_B_9SCB601_0
(SERUM ALBUMIN)		 3ocd SOXX
(Starkeya
novella) 		5 / 12 VAL B 195
LEU B 199
ARG B 180
PHE B 181
LEU B 187
 HEC  B 401 ( 4.6A)
None
None
HEC  B 401 (-3.8A)
None
 1.18A 6a7pB-3ocdB:
undetectable		 6a7pB-3ocdB:
16.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AF6_A_GLYA507_0
(L-PROLYL-[PEPTIDYL-C
ARRIER PROTEIN]
DEHYDROGENASE)		 5djq CBB3-TYPE CYTOCHROME
C OXIDASE SUBUNIT
CCOP1
(Pseudomonas
stutzeri) 		3 / 3 TYR C 229
HIS C 237
MET C 244
 None
HEC  C 401 (-3.1A)
None
 1.24A 6af6A-5djqC:
undetectable		 6af6A-5djqC:
21.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AG0_A_ACRA607_0
(ALPHA-AMYLASE)		 6f0k FE-S-CLUSTER-CONTAIN
ING HYDROGENASE
(Rhodothermus
marinus) 		4 / 4 ARG B 795
SER B 791
ASP B 792
ASN B 796
 None
None
HEC  A 302 ( 4.6A)
None
 1.15A 6ag0A-6f0kB:
undetectable		 6ag0A-6f0kB:
26.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AG0_A_ACRA608_0
(ALPHA-AMYLASE)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		4 / 6 GLY A 592
THR A 606
TYR A 460
TYR A 454
 None
HEC  A 807 (-3.4A)
HEC  A 807 (-3.9A)
None
 1.29A 6ag0A-4lmhA:
undetectable		 6ag0A-4lmhA:
8.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AG0_C_ACRC606_0
(ALPHA-AMYLASE)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		4 / 6 GLY A 592
THR A 606
TYR A 460
TYR A 454
 None
HEC  A 807 (-3.4A)
HEC  A 807 (-3.9A)
None
 1.27A 6ag0C-4lmhA:
undetectable		 6ag0C-4lmhA:
8.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AV6_B_H4BB501_1
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		4 / 7 SER A  74
TRP A  73
PHE A  79
GLU A  71
 None
None
HEC  A 201 (-4.4A)
None
 1.24A 6av6A-5jt4A:
undetectable
6av6B-5jt4A:
undetectable		 6av6A-5jt4A:
18.55
6av6B-5jt4A:
18.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AV7_A_H4BA502_1
(NITRIC OXIDE
SYNTHASE,
ENDOTHELIAL)		 5jt4 CYTOCHROME C'
(Achromobacter
xylosoxidans) 		4 / 7 SER A  74
TRP A  73
PHE A  79
GLU A  71
 None
None
HEC  A 201 (-4.4A)
None
 1.18A 6av7A-5jt4A:
undetectable
6av7B-5jt4A:
undetectable		 6av7A-5jt4A:
18.55
6av7B-5jt4A:
18.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AYC_A_1YNA502_1
(PROTEIN CYP51)		 2vhd CYTOCHROME C551
PEROXIDASE
(Pseudomonas
aeruginosa) 		5 / 12 ALA A 210
PHE A 192
ALA A 254
THR A 256
MET A 275
 None
None
None
CA  A 403 (-4.7A)
HEC  A 402 (-2.3A)
 1.33A 6aycA-2vhdA:
undetectable		 6aycA-2vhdA:
13.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B58_A_ACTA607_0
(FUMARATE REDUCTASE
FLAVOPROTEIN SUBUNIT)		 4xyd NORC-LIKE PROTEIN
(Roseobacter
denitrificans) 		4 / 4 GLY B  80
ARG B  85
ASN B  81
LEU B 133
 None
HEC  B 201 (-3.6A)
None
None
 1.21A 6b58A-4xydB:
undetectable		 6b58A-4xydB:
13.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BPL_B_PA1B605_1
(LIPID A EXPORT
ATP-BINDING/PERMEASE
PROTEIN MSBA)		 1h31 DIHEME CYTOCHROME C
(Rhodovulum
sulfidophilum) 		3 / 3 ARG A 224
ARG A 211
ARG A 218
 None
None
HEC  A1263 ( 3.6A)
 1.05A 6bplA-1h31A:
undetectable
6bplB-1h31A:
undetectable		 6bplA-1h31A:
16.22
6bplB-1h31A:
16.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6BRD_B_RFPB502_2
(RIFAMPIN
MONOOXYGENASE)		 1jmz AMINE DEHYDROGENASE
(Pseudomonas
putida) 		4 / 6 VAL A 386
LEU A  38
ARG A  43
PRO G  76
 None
None
HEC  A1002 ( 3.0A)
None
 1.27A 6brdB-1jmzA:
0.0		 6brdB-1jmzA:
12.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6C06_D_FI8D1404_0
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA')		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		4 / 8 ILE A 610
THR A 611
THR A 616
ARG A 553
 None
HEC  A 810 (-3.9A)
None
None
 1.13A 6c06C-4lm8A:
undetectable		 6c06C-4lm8A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6C2M_B_SUEB1202_0
(NS3 PROTEASE)		 2rf7 CYTOCHROME C-552
(Escherichia
coli) 		5 / 12 GLN A  62
HIS A  94
GLY A  93
VAL A  98
ILE A 283
 HEC  A   3 (-3.8A)
HEC  A   3 (-3.3A)
HEC  A   3 (-3.9A)
None
HEC  A   2 (-4.3A)
 1.09A 6c2mB-2rf7A:
undetectable		 6c2mB-2rf7A:
12.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6C79_A_CE3A301_1
(BETA-LACTAMASE
TOHO-1)		 1tu2 APOCYTOCHROME F
(Nostoc
sp.
PCC
7119) 		5 / 12 ALA B  28
ASN B 234
LYS B  30
GLY B 239
GLY B 158
 None
None
None
None
HEC  B 255 (-3.7A)
 0.77A 6c79A-1tu2B:
undetectable		 6c79A-1tu2B:
13.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6CBZ_A_ESTA601_1
(ESTROGEN RECEPTOR)		 4wqe THIOSULFATE
DEHYDROGENASE
(Allochromatium
vinosum) 		4 / 8 MET A 209
GLU A 221
LEU A 155
HIS A 164
 HEC  A1002 (-2.2A)
None
None
HEC  A1002 (-3.2A)
 0.91A 6cbzA-4wqeA:
undetectable		 6cbzA-4wqeA:
16.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6CNJ_D_NCTD402_1
(NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4
NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
BETA-2)		 3u99 DIHEME CYTOCHROME C
(Shewanella
baltica) 		4 / 8 TYR A  15
CYH A 121
TRP A  36
LEU A  30
 HEC  A 700 ( 4.4A)
HEC  A 500 (-1.9A)
None
HEC  A 500 ( 3.8A)
 1.45A 6cnjD-3u99A:
undetectable
6cnjE-3u99A:
undetectable		 6cnjD-3u99A:
21.33
6cnjE-3u99A:
18.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EBP_A_DAHA123_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE,
BETA SUBUNIT)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		5 / 9 LEU A 521
THR A 518
GLY A 334
ILE A 335
PHE A 438
 None
EDO  A 823 ( 4.7A)
None
None
HEC  A 807 (-4.6A)
 1.33A 6ebpA-4lm8A:
undetectable		 6ebpA-4lm8A:
6.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6ECF_I_DVAI3010_0
(VLM2
DODECADEPSIPEPTIDE)		 5lo9 CYTOCHROME C
(Marichromatium
purpuratum) 		3 / 3 PHE A  55
ARG A 159
ALA A  38
 None
HEC  A1002 ( 3.4A)
HEC  A1001 (-3.6A)
 0.89A 6ecfB-5lo9A:
undetectable		 6ecfB-5lo9A:
21.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6F8C_A_STRA502_1
(CYTOCHROME P450
CYP260A1)		 1zzh CYTOCHROME C
PEROXIDASE
(Rhodobacter
capsulatus) 		4 / 6 ALA A 250
GLY A 284
ILE A 295
PHE A 298
 HEC  A 803 (-3.8A)
HEC  A 803 ( 4.4A)
HEC  A 803 ( 4.4A)
None
 0.78A 6f8cA-1zzhA:
undetectable		 6f8cA-1zzhA:
15.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GIQ_T_PCFT101_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 1,
MITOCHONDRIAL
CYTOCHROME B-C1
COMPLEX SUBUNIT 9
CYTOCHROME B-C1
COMPLEX SUBUNIT
RIESKE,
MITOCHONDRIAL)		 5n1t FLAVIN-BINDING
SUBUNIT OF SULFIDE
DEHYDROGENASE
CYTOCHROME C
(Thioalkalivibrio
paradoxus;
Thioalkalivibrio
paradoxus) 		4 / 8 SER B  50
MET B  53
SER A 337
VAL A 379
 HEC  B 901 (-4.3A)
HEC  B 901 (-2.2A)
None
None
 0.96A 6giqL-5n1tB:
undetectable
6giqP-5n1tB:
undetectable
6giqT-5n1tB:
undetectable		 6giqL-5n1tB:
12.76
6giqP-5n1tB:
18.93
6giqT-5n1tB:
20.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNE_B_ACRB602_2
(-)		 4lm8 EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT MTRC
(Shewanella
oneidensis) 		4 / 8 VAL A 223
TRP A 239
HIS A 230
CYH A 282
 None
HEC  A 801 ( 4.8A)
HEC  A 803 (-3.2A)
HEC  A 804 (-1.8A)
 1.32A 6gneB-4lm8A:
undetectable		 6gneB-4lm8A:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6GNF_C_QPSC602_2
(-)		 6f0k CYTOCHROME C FAMILY
PROTEIN
FE-S-CLUSTER-CONTAIN
ING HYDROGENASE
(Rhodothermus
marinus) 		5 / 12 VAL A 133
ASP A 119
ARG B 958
GLU B 955
PRO A 203
 HEC  A 303 (-4.1A)
None
HEC  A 302 (-3.7A)
None
HEC  A 302 (-4.1A)
 1.16A 6gnfC-6f0kA:
undetectable		 6gnfC-6f0kA:
10.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MN4_B_AM2B301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		4 / 8 ARG A 243
HIS A 240
GLU A 195
ASP A  89
 None
HEC  A 802 (-3.2A)
None
None
 1.08A 6mn4B-4lmhA:
undetectable		 6mn4B-4lmhA:
15.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MN4_C_AM2C301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		4 / 8 ARG A 243
HIS A 240
GLU A 195
ASP A  89
 None
HEC  A 802 (-3.2A)
None
None
 1.30A 6mn4C-4lmhA:
undetectable		 6mn4C-4lmhA:
15.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MN4_E_AM2E301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		4 / 7 ARG A 243
HIS A 240
GLU A 195
ASP A  89
 None
HEC  A 802 (-3.2A)
None
None
 1.32A 6mn4E-4lmhA:
undetectable		 6mn4E-4lmhA:
15.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6MN4_F_AM2F301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		4 / 7 ARG A 243
HIS A 240
GLU A 195
ASP A  89
 None
HEC  A 802 (-3.2A)
None
None
 1.38A 6mn4F-4lmhA:
undetectable		 6mn4F-4lmhA:
15.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NKN_C_CHDC301_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 6 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.29A 6nknA-6btmA:
undetectable
6nknC-6btmA:
undetectable		 6nknA-6btmA:
undetectable
6nknC-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NKN_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 3
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 3s7w EIGHT-HEME NITRITE
REDUCTASE
(Thioalkalivibrio
nitratireducens) 		3 / 3 ARG A 239
PHE A 281
PHE A 228
 HEC  A1002 (-2.8A)
None
HEC  A1002 (-3.8A)
 1.03A 6nknC-3s7wA:
4.1
6nknJ-3s7wA:
undetectable		 6nknC-3s7wA:
17.79
6nknJ-3s7wA:
8.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6NMP_P_CHDP302_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 3)		 6btm ALTERNATIVE COMPLEX
III SUBUNIT A
(Flavobacterium
johnsoniae) 		4 / 7 HIS A 361
ASP A 355
TYR A 358
HIS A 376
 HEC  A1002 (-3.2A)
None
None
HEC  A1002 (-3.2A)
 1.28A 6nmpN-6btmA:
undetectable
6nmpP-6btmA:
undetectable		 6nmpN-6btmA:
undetectable
6nmpP-6btmA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6R2E_C_FFOC404_0
(THYMIDYLATE SYNTHASE)		 2rf7 CYTOCHROME C-552
(Escherichia
coli) 		5 / 10 PHE A  96
ASP A 162
LEU A 158
GLY A 159
ASN A  42
 None
HEC  A   3 ( 4.1A)
HEC  A   3 (-4.2A)
HEC  A   2 (-3.7A)
None
 1.48A 6r2eC-2rf7A:
undetectable		 6r2eC-2rf7A:
19.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
7DFR_A_FOLA161_1
(DIHYDROFOLATE
REDUCTASE)		 4lmh EXTRACELLULAR IRON
OXIDE RESPIRATORY
SYSTEM SURFACE
DECAHEME CYTOCHROME
C COMPONENT OMCA
(Shewanella
oneidensis) 		3 / 3 ASP A 110
LEU A 342
ARG A 220
 None
None
HEC  A 803 (-2.8A)
 0.88A 7dfrA-4lmhA:
undetectable		 7dfrA-4lmhA:
11.92