SIMILAR PATTERNS OF AMINO ACIDS FOR 6DRX_A_H8GA1201

List of similar pattern of amino acids derived from ASSAM search

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 link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. 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.
1c3e GLYCINAMIDE
RIBONUCLEOTIDE
TRANSFORMYLASE

(Escherichia
coli) 		PF00551
(Formyl_trans_N) 		5 LEU A 105
VAL A 136
SER A 135
THR A 134
ALA A 152
 None
 1.40A 6drxA-1c3eA:
undetectable		 6drxA-1c3eA:
19.90
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.
1ey2 HOMOGENTISATE
1,2-DIOXYGENASE

(Homo sapiens) 		PF04209
(HgmA) 		5 VAL A  81
THR A 118
ALA A 132
PHE A 154
ASN A 149
 None
 1.25A 6drxA-1ey2A:
undetectable		 6drxA-1ey2A:
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.
1fim MACROPHAGE MIGRATION
INHIBITORY FACTOR

(Rattus
norvegicus) 		PF01187
(MIF) 		5 LEU A  78
SER A  84
PHE A   3
ALA A  57
PHE A  18
 None
 1.29A 6drxA-1fimA:
undetectable		 6drxA-1fimA:
13.51
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.
1h4p GLUCAN
1,3-BETA-GLUCOSIDASE
I/II

(Saccharomyces
cerevisiae) 		PF00150
(Cellulase) 		5 TRP A 171
LEU A 129
VAL A  56
ALA A 421
PHE A 335
 None
 1.49A 6drxA-1h4pA:
undetectable		 6drxA-1h4pA:
21.16
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.
1k1d D-HYDANTOINASE

(Geobacillus
stearothermophilus) 		PF01979
(Amidohydro_1) 		5 LEU A 361
VAL A 365
SER A 369
THR A 370
VAL A 394
 None
 1.46A 6drxA-1k1dA:
undetectable		 6drxA-1k1dA:
20.91
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.
1k4z ADENYLYL
CYCLASE-ASSOCIATED
PROTEIN

(Saccharomyces
cerevisiae) 		PF08603
(CAP_C) 		5 SER A1484
THR A1485
ALA A1486
PHE A1447
VAL A1441
 None
 1.47A 6drxA-1k4zA:
undetectable		 6drxA-1k4zA:
17.93
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.
1kqo NICOTINAMIDE
MONONUCLEOTIDE
ADENYLYL TRANSFERASE

(Homo sapiens) 		PF01467
(CTP_transf_like) 		5 LEU A  11
VAL A  80
THR A  74
ALA A  73
PHE A  17
 None
None
None
None
DND  A 301 (-4.6A)
 1.46A 6drxA-1kqoA:
undetectable		 6drxA-1kqoA:
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.
1r4p SHIGA-LIKE TOXIN
TYPE II A SUBUNIT

(Escherichia
coli) 		PF00161
(RIP) 		5 TRP A 202
LEU A 239
VAL A  40
SER A  25
THR A  26
 None
None
None
None
NA  A4001 ( 4.7A)
 1.43A 6drxA-1r4pA:
undetectable		 6drxA-1r4pA:
19.22
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.
1rt8 FIMBRIN

(Schizosaccharomyces
pombe) 		PF00307
(CH) 		5 VAL A 545
PHE A 607
ALA A 575
VAL A 557
TYR A 559
 None
 1.26A 6drxA-1rt8A:
undetectable		 6drxA-1rt8A:
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.
1sr4 CYTOLETHAL
DISTENDING TOXIN
SUBUNIT A
CYTOLETHAL
DISTENDING TOXIN
PROTEIN B
CYTOLETHAL
DISTENDING TOXIN
PROTEIN C

([Haemophilus]
ducreyi;
[Haemophilus]
ducreyi;
[Haemophilus]
ducreyi) 		PF03498
(CDtoxinA)
PF03372
(Exo_endo_phos)
PF03498
(CDtoxinA) 		5 TRP B  93
LEU B  95
VAL A 222
ALA A 219
PHE C 125
 None
 1.41A 6drxA-1sr4B:
undetectable		 6drxA-1sr4B:
21.52
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.
1ufr PYR MRNA-BINDING
ATTENUATION PROTEIN

(Thermus
thermophilus) 		PF00156
(Pribosyltran) 		5 VAL A  25
THR A  31
PHE A  57
VAL A 100
TYR A 129
 None
 1.46A 6drxA-1ufrA:
undetectable		 6drxA-1ufrA:
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.
1x5r GLUTAMATE RECEPTOR
INTERACTING PROTEIN
2

(Homo sapiens) 		PF00595
(PDZ) 		5 VAL A  70
SER A  72
THR A  78
ALA A  86
VAL A 100
 None
 1.33A 6drxA-1x5rA:
undetectable		 6drxA-1x5rA:
14.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yew PARTICULATE METHANE
MONOOXYGENASE, A
SUBUNIT
PARTICULATE METHANE
MONOOXYGENASE
SUBUNIT C2

(Methylococcus
capsulatus;
Methylococcus
capsulatus) 		PF02461
(AMO)
PF04896
(AmoC) 		5 TRP B 111
VAL C  65
PHE C  92
TRP C 147
TYR C 151
 None
 1.43A 6drxA-1yewB:
undetectable		 6drxA-1yewB:
19.19
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.
2adu METHIONINE
AMINOPEPTIDASE 2

(Homo sapiens) 		PF00557
(Peptidase_M24) 		5 SER A 473
THR A 461
PHE A 219
ALA A 362
TYR A 478
 None
None
R20  A 906 ( 3.8A)
CO  A 502 ( 3.8A)
None
 1.46A 6drxA-2aduA:
undetectable		 6drxA-2aduA:
21.61
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.
2eja UROPORPHYRINOGEN
DECARBOXYLASE

(Aquifex
aeolicus) 		PF01208
(URO-D) 		5 VAL A 309
SER A  10
ALA A 255
PHE A 268
VAL A 304
 None
 1.44A 6drxA-2ejaA:
undetectable		 6drxA-2ejaA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2irp PUTATIVE ALDOLASE
CLASS 2 PROTEIN
AQ_1979

(Aquifex
aeolicus) 		PF00596
(Aldolase_II) 		5 VAL A  98
SER A  37
ALA A  19
VAL A  94
TYR A  88
 None
 1.33A 6drxA-2irpA:
undetectable		 6drxA-2irpA:
18.10
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.
2oox HYPOTHETICAL PROTEIN
C1556.08C IN
CHROMOSOME I

(Schizosaccharomyces
pombe) 		no annotation 5 LEU G 240
SER G 252
THR G 202
ALA G 198
ASN G 230
 None
 1.47A 6drxA-2ooxG:
undetectable		 6drxA-2ooxG:
22.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2q5o PHENYLPYRUVATE
DECARBOXYLASE

(Azospirillum
brasilense) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 LEU A 118
SER A  97
THR A  71
PHE A  77
TYR A 160
 None
None
PPY  A5001 ( 4.2A)
None
None
 1.40A 6drxA-2q5oA:
undetectable		 6drxA-2q5oA:
22.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v73 PUTATIVE
EXO-ALPHA-SIALIDASE

(Clostridium
perfringens) 		PF02973
(Sialidase) 		5 LEU A  69
VAL A  71
PHE A  44
ASN A 121
VAL A 125
 None
 1.23A 6drxA-2v73A:
undetectable		 6drxA-2v73A:
21.46
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.
2w5s PROCESSED GLYCEROL
PHOSPHATE
LIPOTEICHOIC ACID
SYNTHASE

(Staphylococcus
aureus) 		PF00884
(Sulfatase) 		5 LEU A 314
SER A 301
PHE A 363
ASN A 309
VAL A 359
 None
 1.41A 6drxA-2w5sA:
undetectable		 6drxA-2w5sA:
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.
2x0n GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
GLYCOSOMAL

(Trypanosoma
brucei) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 LEU A  26
VAL A  79
ALA A  46
PHE A   9
VAL A  35
 None
 1.49A 6drxA-2x0nA:
undetectable		 6drxA-2x0nA:
22.88
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.
2x0n GLYCERALDEHYDE-3-PHO
SPHATE
DEHYDROGENASE,
GLYCOSOMAL

(Trypanosoma
brucei) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 LEU A  26
VAL A  79
PHE A  58
PHE A   9
VAL A  35
 None
 1.40A 6drxA-2x0nA:
undetectable		 6drxA-2x0nA:
22.88
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.
2yof THYMIDYLATE KINASE

(Plasmodium
falciparum) 		PF02223
(Thymidylate_kin) 		5 TRP A  94
LEU A  32
VAL A  96
PHE A 133
VAL A 131
 None
 1.49A 6drxA-2yofA:
undetectable		 6drxA-2yofA:
15.85
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.
3bwx ALPHA/BETA HYDROLASE

(Novosphingobium
aromaticivorans) 		PF12697
(Abhydrolase_6) 		5 SER A 165
PHE A 195
ALA A 160
TRP A 177
TYR A 169
 None
None
EDO  A 298 (-3.9A)
None
None
 1.29A 6drxA-3bwxA:
undetectable		 6drxA-3bwxA:
22.12
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.
3d1c FLAVIN-CONTAINING
PUTATIVE
MONOOXYGENASE

(Staphylococcus
aureus) 		PF13738
(Pyr_redox_3) 		5 LEU A 193
VAL A 169
THR A 259
PHE A 251
VAL A 237
 None
 1.43A 6drxA-3d1cA:
undetectable		 6drxA-3d1cA:
21.30
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.
3k25 SLR1438 PROTEIN

(Synechocystis
sp. PCC 6803) 		PF01263
(Aldose_epim) 		5 TRP A  99
VAL A  28
THR A  13
PHE A  53
TYR A 136
 None
 1.37A 6drxA-3k25A:
undetectable		 6drxA-3k25A:
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.
3ljf IRON SUPEROXIDE
DISMUTASE

(Pseudoalteromonas
haloplanktis) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		5 TRP A  77
LEU A  80
VAL A 156
THR A 123
ALA A 114
 None
 1.25A 6drxA-3ljfA:
undetectable		 6drxA-3ljfA:
17.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3loq UNIVERSAL STRESS
PROTEIN

(Archaeoglobus
fulgidus) 		PF00582
(Usp) 		5 VAL A 169
THR A 173
PHE A 232
PHE A  21
VAL A  26
 None
 1.45A 6drxA-3loqA:
undetectable		 6drxA-3loqA:
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.
3lvv GLUTAMATE--CYSTEINE
LIGASE

(Saccharomyces
cerevisiae) 		PF03074
(GCS) 		5 LEU A 367
VAL A 365
SER A 364
THR A 447
ALA A 290
 None
 1.22A 6drxA-3lvvA:
undetectable		 6drxA-3lvvA:
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.
3odj RHOMBOID PROTEASE
GLPG

(Haemophilus
influenzae) 		PF01694
(Rhomboid) 		5 SER A  97
THR A 100
ALA A 168
ASN A  69
TYR A  93
 None
 1.39A 6drxA-3odjA:
undetectable		 6drxA-3odjA:
19.95
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.
3ois CYSTEINE PROTEASE

(Xylella
fastidiosa) 		PF00112
(Peptidase_C1) 		5 SER A  77
THR A  79
ALA A 238
ASN A 255
TYR A 146
 None
 1.48A 6drxA-3oisA:
undetectable		 6drxA-3oisA:
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.
3p54 ENVELOPE
GLYCOPROTEIN

(Japanese
encephalitis
virus) 		PF00869
(Flavi_glycoprot)
PF02832
(Flavi_glycop_C) 		5 ALA A 157
PHE A 142
ASN A   2
VAL A 143
TYR A 183
 None
 1.27A 6drxA-3p54A:
undetectable		 6drxA-3p54A:
20.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3pds FUSION PROTEIN
BETA-2 ADRENERGIC
RECEPTOR/LYSOZYME

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		6 TRP A 109
VAL A 114
THR A 118
TRP A 286
PHE A 289
ASN A 293
 None
ERC  A1201 (-3.8A)
None
None
ERC  A1201 (-4.5A)
ERC  A1201 (-3.5A)
 0.93A 6drxA-3pdsA:
28.5		 6drxA-3pdsA:
30.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3pds FUSION PROTEIN
BETA-2 ADRENERGIC
RECEPTOR/LYSOZYME

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		6 TRP A 109
VAL A 114
TRP A 286
PHE A 289
ASN A 293
TYR A 316
 None
ERC  A1201 (-3.8A)
None
ERC  A1201 (-4.5A)
ERC  A1201 (-3.5A)
None
 0.82A 6drxA-3pdsA:
28.5		 6drxA-3pdsA:
30.35
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.
3qpd CUTINASE 1

(Aspergillus
oryzae) 		PF01083
(Cutinase) 		5 LEU A 152
THR A 201
ALA A  61
PHE A  42
VAL A 121
 None
 1.33A 6drxA-3qpdA:
undetectable		 6drxA-3qpdA:
19.54
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.
3r8x METHIONYL-TRNA
FORMYLTRANSFERASE

(Yersinia pestis) 		PF00551
(Formyl_trans_N)
PF02911
(Formyl_trans_C) 		5 TRP A 118
VAL A 128
SER A 165
THR A 164
PHE A 231
 None
None
None
MOE  A 323 ( 4.5A)
None
 1.46A 6drxA-3r8xA:
undetectable		 6drxA-3r8xA:
24.23
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.
3rze HISTAMINE H1
RECEPTOR, LYSOZYME
CHIMERA

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		6 TRP A 103
LEU A 104
SER A 111
THR A 112
TRP A 428
TYR A 458
 None
None
5EH  A1200 ( 3.7A)
D7V  A1201 ( 4.0A)
5EH  A1200 ( 3.4A)
5EH  A1200 ( 4.4A)
 0.79A 6drxA-3rzeA:
27.4		 6drxA-3rzeA:
27.81
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.
3sfw DIHYDROPYRIMIDINASE

(Brevibacillus
agri) 		PF01979
(Amidohydro_1) 		5 LEU A 361
VAL A 365
SER A 369
THR A 370
VAL A 394
 None
 1.42A 6drxA-3sfwA:
undetectable		 6drxA-3sfwA:
21.85
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.
3un6 HYPOTHETICAL PROTEIN
SAOUHSC_00137

(Staphylococcus
aureus) 		PF13379
(NMT1_2) 		5 VAL A 222
SER A  91
THR A  92
PHE A 312
TYR A 244
 None
 1.29A 6drxA-3un6A:
undetectable		 6drxA-3un6A:
23.35
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.
3uon HUMAN M2 MUSCARINIC
ACETYLCHOLINE,
RECEPTOR T4 LYSOZYME
FUSION PROTEIN

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		5 TRP A  99
LEU A 100
SER A 107
PHE A 181
ALA A 194
 None
None
QNB  A1162 (-3.4A)
QNB  A1162 (-4.4A)
QNB  A1162 ( 4.0A)
 0.99A 6drxA-3uonA:
26.7		 6drxA-3uonA:
27.97
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.
3uon HUMAN M2 MUSCARINIC
ACETYLCHOLINE,
RECEPTOR T4 LYSOZYME
FUSION PROTEIN

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		5 TRP A  99
LEU A 100
SER A 107
PHE A 181
TRP A 400
 None
None
QNB  A1162 (-3.4A)
QNB  A1162 (-4.4A)
QNB  A1162 (-4.7A)
 1.31A 6drxA-3uonA:
26.7		 6drxA-3uonA:
27.97
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.
3wfz LACTO-N-BIOSE
PHOSPHORYLASE

(Bifidobacterium
longum) 		PF09508
(Lact_bio_phlase)
PF17385
(LBP_M)
PF17386
(LBP_C) 		5 VAL A 519
THR A 521
ALA A 548
ASN A 506
VAL A 529
 None
 1.34A 6drxA-3wfzA:
undetectable		 6drxA-3wfzA:
18.50
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.
4eog PUTATIVE
UNCHARACTERIZED
PROTEIN

(Pyrococcus
furiosus) 		PF09455
(Cas_DxTHG) 		5 ALA A 435
PHE A 253
ASN A 251
VAL A 256
TYR A 459
 None
 1.32A 6drxA-4eogA:
undetectable		 6drxA-4eogA:
22.09
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.
4fgs PROBABLE
DEHYDROGENASE
PROTEIN

(Rhizobium etli) 		PF13561
(adh_short_C2) 		5 VAL A 222
ALA A  22
PHE A  86
ASN A  88
VAL A 134
 None
 1.02A 6drxA-4fgsA:
undetectable		 6drxA-4fgsA:
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.
4fys AMINOPEPTIDASE N

(Homo sapiens) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		5 LEU A 325
ALA A 414
ASN A 397
VAL A 360
TYR A 362
 None
 1.39A 6drxA-4fysA:
undetectable		 6drxA-4fysA:
17.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4gbr BETA-2 ADRENERGIC
RECEPTOR

(Homo sapiens) 		PF00001
(7tm_1) 		7 TRP A 109
VAL A 114
THR A 118
TRP A 258
PHE A 261
ASN A 265
TYR A 288
 None
CAU  A 500 (-3.5A)
CAU  A 500 ( 4.7A)
None
CAU  A 500 (-4.2A)
CAU  A 500 (-3.4A)
CAU  A 500 (-4.6A)
 0.93A 6drxA-4gbrA:
28.8		 6drxA-4gbrA:
30.19
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.
4gq2 NUCLEOPORIN NUP120

(Schizosaccharomyces
pombe) 		PF11715
(Nup160) 		5 VAL M 731
SER M 732
PHE M 802
TRP M 834
VAL M 603
 None
 1.32A 6drxA-4gq2M:
undetectable		 6drxA-4gq2M:
17.52
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.
4hq6 ACETYL-COA
CARBOXYLASE 2

(Homo sapiens) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 TRP A 351
SER A 685
THR A 668
ALA A 308
TYR A 683
 None
 1.41A 6drxA-4hq6A:
undetectable		 6drxA-4hq6A:
21.07
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.
4i2o FIXK2 PROTEIN

(Bradyrhizobium
japonicum) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		5 VAL A 112
SER A  44
THR A 110
PHE A  92
ALA A 106
 None
 1.33A 6drxA-4i2oA:
undetectable		 6drxA-4i2oA:
17.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ib4 CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 2B AND E.
COLI SOLUBLE
CYTOCHROME B562

(Escherichia
coli;
Homo sapiens) 		PF00001
(7tm_1)
PF07361
(Cytochrom_B562) 		12 TRP A 131
LEU A 132
VAL A 136
SER A 139
THR A 140
PHE A 217
ALA A 225
TRP A 337
PHE A 340
ASN A 344
VAL A 366
TYR A 370
 None
None
ERM  A2001 (-3.8A)
ERM  A2001 (-3.6A)
ERM  A2001 (-3.9A)
ERM  A2001 (-4.6A)
ERM  A2001 (-3.4A)
None
ERM  A2001 (-4.3A)
ERM  A2001 (-4.3A)
ERM  A2001 ( 4.2A)
ERM  A2001 ( 4.8A)
 0.38A 6drxA-4ib4A:
46.2		 6drxA-4ib4A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ib4 CHIMERA PROTEIN OF
HUMAN
5-HYDROXYTRYPTAMINE
RECEPTOR 2B AND E.
COLI SOLUBLE
CYTOCHROME B562

(Escherichia
coli;
Homo sapiens) 		PF00001
(7tm_1)
PF07361
(Cytochrom_B562) 		5 VAL A 136
SER A 139
PHE A 217
TRP A 337
PHE A 341
 ERM  A2001 (-3.8A)
ERM  A2001 (-3.6A)
ERM  A2001 (-4.6A)
None
None
 1.45A 6drxA-4ib4A:
46.2		 6drxA-4ib4A:
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.
4kqn D-HYDANTOINASE

(Bacillus sp.
AR9) 		PF01979
(Amidohydro_1) 		5 LEU A 361
VAL A 365
SER A 369
THR A 370
VAL A 394
 LEU  A 361 ( 0.5A)
VAL  A 365 ( 0.5A)
SER  A 369 ( 0.0A)
THR  A 370 ( 0.8A)
VAL  A 394 ( 0.6A)
 1.40A 6drxA-4kqnA:
undetectable		 6drxA-4kqnA:
21.60
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.
4lde LYSOZYME, BETA-2
ADRENERGIC RECEPTOR

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		7 TRP A1109
VAL A1114
THR A1118
TRP A1286
PHE A1289
ASN A1293
TYR A1316
 None
P0G  A1401 (-3.7A)
None
None
P0G  A1401 ( 4.7A)
P0G  A1401 (-3.0A)
None
 0.53A 6drxA-4ldeA:
29.4		 6drxA-4ldeA:
25.72
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.
4mqt MUSCARINIC
ACETYLCHOLINE
RECEPTOR M2

(Homo sapiens) 		PF00001
(7tm_1) 		5 TRP A  99
LEU A 100
SER A 107
ALA A 194
TRP A 400
 None
None
IXO  A 501 (-3.4A)
IXO  A 501 (-3.5A)
IXO  A 501 (-4.6A)
 0.60A 6drxA-4mqtA:
29.0		 6drxA-4mqtA:
27.42
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.
4mqt MUSCARINIC
ACETYLCHOLINE
RECEPTOR M2

(Homo sapiens) 		PF00001
(7tm_1) 		5 TRP A  99
LEU A 100
SER A 107
ALA A 194
TYR A 430
 None
None
IXO  A 501 (-3.4A)
IXO  A 501 (-3.5A)
IXO  A 501 (-4.5A)
 0.76A 6drxA-4mqtA:
29.0		 6drxA-4mqtA:
27.42
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.
4n5c CARGO-TRANSPORT
PROTEIN YPP1

(Saccharomyces
cerevisiae) 		no annotation 5 LEU A 121
VAL A 157
SER A 158
PHE A 168
VAL A 167
 None
 1.46A 6drxA-4n5cA:
undetectable		 6drxA-4n5cA:
19.58
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.
4nfu EDS1

(Arabidopsis
thaliana) 		PF01764
(Lipase_3) 		5 LEU A 211
PHE A  52
ALA A 127
VAL A 183
TYR A 320
 None
 1.44A 6drxA-4nfuA:
2.9		 6drxA-4nfuA:
22.26
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.
4ni5 OXIDOREDUCTASE,
SHORT-CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY PROTEIN

(Brucella suis) 		PF13561
(adh_short_C2) 		5 VAL A 217
ALA A  20
PHE A  86
ASN A  88
VAL A 136
 None
 1.05A 6drxA-4ni5A:
undetectable		 6drxA-4ni5A:
20.59
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.
4o89 RNA 3'-TERMINAL
PHOSPHATE CYCLASE

(Pyrococcus
horikoshii) 		PF01137
(RTC)
PF05189
(RTC_insert) 		5 LEU A  16
VAL A  20
SER A  23
THR A  24
ALA A  59
 None
 1.03A 6drxA-4o89A:
undetectable		 6drxA-4o89A:
22.51
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.
4o89 RNA 3'-TERMINAL
PHOSPHATE CYCLASE

(Pyrococcus
horikoshii) 		PF01137
(RTC)
PF05189
(RTC_insert) 		5 VAL A  20
SER A  23
THR A  24
ALA A  59
VAL A  74
 None
 1.43A 6drxA-4o89A:
undetectable		 6drxA-4o89A:
22.51
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.
4p9n CARBOXYLESTERASE

(Sulfolobus
shibatae) 		PF07859
(Abhydrolase_3) 		5 VAL A  17
PHE A 197
TRP A 205
PHE A 206
VAL A  83
 None
 1.40A 6drxA-4p9nA:
undetectable		 6drxA-4p9nA:
21.81
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.
4pju COHESIN SUBUNIT SA-2
DOUBLE-STRAND-BREAK
REPAIR PROTEIN RAD21
HOMOLOG

(Homo sapiens;
Homo sapiens) 		PF08514
(STAG)
no annotation 		5 VAL A 376
SER A 377
THR A 379
ALA A 390
TYR B 344
 None
 1.32A 6drxA-4pjuA:
2.5		 6drxA-4pjuA:
18.04
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.
4u14 MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,ENDOLYSIN,MUSCARI
NIC ACETYLCHOLINE
RECEPTOR M3

(Rattus
norvegicus;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		5 TRP A 143
LEU A 144
SER A 151
ALA A 238
TRP A 503
 None
None
0HK  A2000 (-3.3A)
0HK  A2000 ( 3.8A)
0HK  A2000 (-4.3A)
 1.49A 6drxA-4u14A:
27.3		 6drxA-4u14A:
28.54
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.
4u16 MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3

(Rattus
norvegicus;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		5 TRP A 143
LEU A 144
SER A 151
ALA A 238
TRP A 503
 None
None
3C0  A1202 (-2.9A)
3C0  A1202 (-3.5A)
3C0  A1202 ( 4.0A)
 1.46A 6drxA-4u16A:
25.6		 6drxA-4u16A:
29.23
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.
4wz9 AGAP004809-PA

(Anopheles
gambiae) 		PF01433
(Peptidase_M1)
PF11838
(ERAP1_C) 		5 LEU A 301
ALA A 392
ASN A 375
VAL A 338
TYR A 340
 None
ZN  A1001 ( 3.9A)
None
None
None
 1.32A 6drxA-4wz9A:
undetectable		 6drxA-4wz9A:
18.25
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.
4zhj MG-CHELATASE SUBUNIT
CHLH

(Synechocystis
sp. PCC 6803) 		PF02514
(CobN-Mg_chel)
PF11965
(DUF3479) 		5 LEU A 165
SER A  86
PHE A 186
PHE A 204
TYR A  34
 None
 1.27A 6drxA-4zhjA:
3.1		 6drxA-4zhjA:
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.
5cio PYRROLOQUINOLINE
QUINONE BIOSYNTHESIS
PROTEIN PQQF

(Serratia sp.
FS14) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		5 LEU A 203
ALA A 103
TRP A  70
PHE A  91
VAL A  93
 None
 1.40A 6drxA-5cioA:
undetectable		 6drxA-5cioA:
19.05
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.
5dsg MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4

(Homo sapiens;
Escherichia
virus T4) 		PF00001
(7tm_1)
PF00959
(Phage_lysozyme) 		5 TRP A 108
LEU A 109
SER A 116
ALA A 203
TRP A 413
 None
P6G  A1205 (-4.7A)
0HK  A1201 (-3.3A)
0HK  A1201 (-3.6A)
0HK  A1201 (-4.3A)
 1.22A 6drxA-5dsgA:
27.4		 6drxA-5dsgA:
29.55
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.
5end 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
REDUCTASE FABG

(Vibrio cholerae) 		PF13561
(adh_short_C2) 		5 LEU A  87
VAL A 180
THR A 235
PHE A 165
VAL A 162
 None
 1.47A 6drxA-5endA:
undetectable		 6drxA-5endA:
21.20
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.
5et1 ESPIN

(Mus musculus) 		PF12796
(Ank_2)
PF13637
(Ank_4)
PF13857
(Ank_5) 		5 VAL A  64
SER A  65
THR A  72
ALA A  74
VAL A  56
 None
 1.36A 6drxA-5et1A:
undetectable		 6drxA-5et1A:
21.82
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.
5f8u BETA-1 ADRENERGIC
RECEPTOR

(Meleagris
gallopavo) 		no annotation 5 TRP B 117
VAL B 122
THR B 126
PHE B 306
ASN B 310
 P32  B 400 (-4.8A)
P32  B 400 (-3.5A)
None
P32  B 400 (-4.1A)
P32  B 400 (-3.5A)
 0.67A 6drxA-5f8uB:
29.6		 6drxA-5f8uB:
29.93
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.
5f8u BETA-1 ADRENERGIC
RECEPTOR

(Meleagris
gallopavo) 		no annotation 5 VAL B 122
THR B 126
TRP B 303
PHE B 306
ASN B 310
 P32  B 400 (-3.5A)
None
None
P32  B 400 (-4.1A)
P32  B 400 (-3.5A)
 0.87A 6drxA-5f8uB:
29.6		 6drxA-5f8uB:
29.93
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.
5f8u BETA-1 ADRENERGIC
RECEPTOR

(Meleagris
gallopavo) 		no annotation 5 VAL B 122
TRP B 303
PHE B 306
ASN B 310
TYR B 333
 P32  B 400 (-3.5A)
None
P32  B 400 (-4.1A)
P32  B 400 (-3.5A)
P32  B 400 (-4.6A)
 0.61A 6drxA-5f8uB:
29.6		 6drxA-5f8uB:
29.93
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.
5fif CARBOXYLASE

(Deinococcus
radiodurans) 		PF01039
(Carboxyl_trans) 		5 TRP A 444
VAL A 380
THR A 382
VAL A 304
TYR A 302
 None
 1.38A 6drxA-5fifA:
undetectable		 6drxA-5fifA:
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.
5hlb PENICILLIN-BINDING
PROTEIN 1B

(Escherichia
coli) 		PF00905
(Transpeptidase)
PF00912
(Transgly)
PF14814
(UB2H) 		5 TRP A 672
LEU A 783
VAL A 785
THR A 787
PHE A 774
 None
 1.29A 6drxA-5hlbA:
undetectable		 6drxA-5hlbA:
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.
5hyz GRAS FAMILY
TRANSCRIPTION FACTOR
CONTAINING PROTEIN,
EXPRESSED

(Oryza sativa) 		PF03514
(GRAS) 		5 LEU A 572
VAL A 574
SER A 575
ALA A 303
ASN A 409
 None
 1.05A 6drxA-5hyzA:
undetectable		 6drxA-5hyzA:
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.
5jou ALPHA-XYLOSIDASE
BOGH31A

(Bacteroides
ovatus) 		PF01055
(Glyco_hydro_31)
PF16338
(DUF4968)
PF17137
(DUF5110) 		5 TRP A 753
SER A 623
THR A 624
ALA A 592
TYR A 882
 None
 1.45A 6drxA-5jouA:
undetectable		 6drxA-5jouA:
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.
5lew DNA POLYMERASE III
SUBUNIT ALPHA

(Mycobacterium
tuberculosis) 		no annotation 5 VAL A 794
SER A 795
THR A 798
PHE A 656
VAL A 660
 None
None
SO4  A1012 ( 4.9A)
None
None
 1.44A 6drxA-5lewA:
undetectable		 6drxA-5lewA:
19.35
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.
5lw7 ABC TRANSPORTER
ATP-BINDING PROTEIN

(Pyrococcus
abyssi) 		PF00005
(ABC_tran)
PF00037
(Fer4)
PF04068
(RLI) 		5 LEU B  94
ALA B 124
TRP B 138
PHE B 154
VAL B 141
 None
 1.41A 6drxA-5lw7B:
undetectable		 6drxA-5lw7B:
20.90
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.
5m5p PRE-MRNA-SPLICING
HELICASE BRR2

(Saccharomyces
cerevisiae) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF02889
(Sec63) 		5 VAL A1858
SER A1859
THR A1862
ALA A1886
VAL A1483
 None
 1.42A 6drxA-5m5pA:
undetectable		 6drxA-5m5pA:
12.90
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.
5mr6 XIAF PROTEIN

(Streptomyces
sp.) 		PF08028
(Acyl-CoA_dh_2) 		5 LEU A  55
VAL A  89
SER A  86
THR A  85
VAL A  77
 None
 1.46A 6drxA-5mr6A:
undetectable		 6drxA-5mr6A:
23.23
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.
5mzo UDP-GLUCOSE-GLYCOPRO
TEIN
GLUCOSYLTRANSFERASE-
LIKE PROTEIN

(Chaetomium
thermophilum) 		PF06427
(UDP-g_GGTase) 		5 SER A  41
PHE A1129
ALA A  37
ASN A 230
VAL A 976
 EDO  A1615 (-2.1A)
None
None
None
EDO  A1615 ( 4.7A)
 1.02A 6drxA-5mzoA:
undetectable		 6drxA-5mzoA:
14.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uju NAD-DEPENDENT
ALDEHYDE
DEHYDROGENASE

(Burkholderia
multivorans) 		PF00171
(Aldedh) 		5 SER A 339
PHE A 208
ALA A 345
PHE A 449
VAL A 398
 None
None
NA  A 601 ( 4.2A)
None
None
 1.15A 6drxA-5ujuA:
undetectable		 6drxA-5ujuA:
21.75
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.
5v54 5-HYDROXYTRYPTAMINE
RECEPTOR 1B,OB-1
FUSED 5-HT1B
RECEPTOR,5-HYDROXYTR
YPTAMINE RECEPTOR 1B

(Spodoptera
frugiperda;
Homo sapiens) 		no annotation 5 LEU A 126
THR A 134
ALA A 216
PHE A 330
TYR A 359
 89F  A1201 (-4.9A)
89F  A1201 (-4.2A)
89F  A1201 ( 3.9A)
89F  A1201 (-4.1A)
None
 0.97A 6drxA-5v54A:
32.3		 6drxA-5v54A:
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.
5v54 5-HYDROXYTRYPTAMINE
RECEPTOR 1B,OB-1
FUSED 5-HT1B
RECEPTOR,5-HYDROXYTR
YPTAMINE RECEPTOR 1B

(Spodoptera
frugiperda;
Homo sapiens) 		no annotation 5 THR A 134
ALA A 216
TRP A 327
PHE A 330
TYR A 359
 89F  A1201 (-4.2A)
89F  A1201 ( 3.9A)
89F  A1201 (-3.6A)
89F  A1201 (-4.1A)
None
 0.77A 6drxA-5v54A:
32.3		 6drxA-5v54A:
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.
5v54 5-HYDROXYTRYPTAMINE
RECEPTOR 1B,OB-1
FUSED 5-HT1B
RECEPTOR,5-HYDROXYTR
YPTAMINE RECEPTOR 1B

(Spodoptera
frugiperda;
Homo sapiens) 		no annotation 5 TRP A 125
LEU A 126
THR A 134
ALA A 216
PHE A 330
 None
89F  A1201 (-4.9A)
89F  A1201 (-4.2A)
89F  A1201 ( 3.9A)
89F  A1201 (-4.1A)
 0.96A 6drxA-5v54A:
32.3		 6drxA-5v54A:
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.
5wgx FLAVIN-DEPENDENT
HALOGENASE

(Malbranchea
aurantiaca) 		PF04820
(Trp_halogenase) 		5 VAL A 266
SER A 319
THR A 318
PHE A 359
PHE A 346
 None
 0.96A 6drxA-5wgxA:
undetectable		 6drxA-5wgxA:
19.44
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5wiv D(4) DOPAMINE
RECEPTOR, SOLUBLE
CYTOCHROME B562
CHIMERA

(Escherichia
coli;
Homo sapiens) 		no annotation 5 VAL A 116
THR A 120
TRP A 407
PHE A 410
TYR A 438
 AQD  A1201 ( 3.9A)
AQD  A1201 (-4.4A)
None
AQD  A1201 (-4.7A)
None
 0.73A 6drxA-5wivA:
28.4		 6drxA-5wivA:
51.16
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.
5xjv DUAL SPECIFICITY
PROTEIN PHOSPHATASE
13 ISOFORM A

(Homo sapiens) 		no annotation 5 VAL A  88
SER A  87
THR A  65
ALA A 123
PHE A 113
 None
 1.41A 6drxA-5xjvA:
undetectable		 6drxA-5xjvA:
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.
5yv5 ATPASE RIL

(Pyrococcus
furiosus) 		no annotation 5 LEU A  90
ALA A 120
TRP A 134
PHE A 150
VAL A 137
 None
 1.27A 6drxA-5yv5A:
undetectable		 6drxA-5yv5A:
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.
6bng 2-DEHYDRO-3-DEOXYPHO
SPHOOCTONATE
ALDOLASE

(Acinetobacter
baumannii) 		no annotation 5 VAL A  10
ALA A 236
PHE A  26
ASN A 140
VAL A  57
 None
 1.49A 6drxA-6bngA:
undetectable		 6drxA-6bngA:
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.
6bqh 5-HYDROXYTRYPTAMINE
RECEPTOR 2C,SOLUBLE
CYTOCHROME B562

(Escherichia
coli;
Homo sapiens) 		no annotation 5 LEU A 209
SER A 138
TRP A 324
VAL A 354
TYR A 358
 None
E2J  A1201 (-3.2A)
E2J  A1201 ( 3.7A)
E2J  A1201 (-4.6A)
None
 1.48A 6drxA-6bqhA:
31.7		 6drxA-6bqhA:
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.
6bqh 5-HYDROXYTRYPTAMINE
RECEPTOR 2C,SOLUBLE
CYTOCHROME B562

(Escherichia
coli;
Homo sapiens) 		no annotation 7 TRP A 130
SER A 138
THR A 139
TRP A 324
PHE A 327
VAL A 354
TYR A 358
 None
E2J  A1201 (-3.2A)
E2J  A1201 (-4.3A)
E2J  A1201 ( 3.7A)
E2J  A1201 (-4.6A)
E2J  A1201 (-4.6A)
None
 0.74A 6drxA-6bqhA:
31.7		 6drxA-6bqhA:
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.
6bqh 5-HYDROXYTRYPTAMINE
RECEPTOR 2C,SOLUBLE
CYTOCHROME B562

(Escherichia
coli;
Homo sapiens) 		no annotation 7 TRP A 130
SER A 138
TRP A 324
PHE A 327
ASN A 331
VAL A 354
TYR A 358
 None
E2J  A1201 (-3.2A)
E2J  A1201 ( 3.7A)
E2J  A1201 (-4.6A)
None
E2J  A1201 (-4.6A)
None
 0.63A 6drxA-6bqhA:
31.7		 6drxA-6bqhA:
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.
6bqh 5-HYDROXYTRYPTAMINE
RECEPTOR 2C,SOLUBLE
CYTOCHROME B562

(Escherichia
coli;
Homo sapiens) 		no annotation 7 TRP A 130
VAL A 135
SER A 138
THR A 139
ALA A 222
TRP A 324
TYR A 358
 None
E2J  A1201 (-3.8A)
E2J  A1201 (-3.2A)
E2J  A1201 (-4.3A)
E2J  A1201 ( 3.8A)
E2J  A1201 ( 3.7A)
None
 0.64A 6drxA-6bqhA:
31.7		 6drxA-6bqhA:
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.
6bqh 5-HYDROXYTRYPTAMINE
RECEPTOR 2C,SOLUBLE
CYTOCHROME B562

(Escherichia
coli;
Homo sapiens) 		no annotation 7 TRP A 130
VAL A 135
SER A 138
THR A 139
TRP A 324
PHE A 327
TYR A 358
 None
E2J  A1201 (-3.8A)
E2J  A1201 (-3.2A)
E2J  A1201 (-4.3A)
E2J  A1201 ( 3.7A)
E2J  A1201 (-4.6A)
None
 0.70A 6drxA-6bqhA:
31.7		 6drxA-6bqhA:
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.
6bv2 AMINOPEPTIDASE N

(Sus scrofa) 		no annotation 5 LEU A 320
ALA A 409
ASN A 392
VAL A 355
TYR A 357
 None
ZN  A1035 ( 4.0A)
None
None
None
 1.32A 6drxA-6bv2A:
undetectable		 6drxA-6bv2A:
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.
6g79 5-HYDROXYTRYPTAMINE
RECEPTOR 1B

(Homo sapiens) 		no annotation 6 LEU S 126
THR S 134
ALA S 216
TRP S 327
PHE S 330
TYR S 359
 None
EP5  S 401 (-3.8A)
EP5  S 401 ( 4.0A)
None
EP5  S 401 (-4.0A)
EP5  S 401 ( 4.9A)
 0.60A 6drxA-6g79S:
28.9		 6drxA-6g79S:
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.
6g79 5-HYDROXYTRYPTAMINE
RECEPTOR 1B

(Homo sapiens) 		no annotation 6 TRP S 125
LEU S 126
THR S 134
ALA S 216
TRP S 327
TYR S 359
 None
None
EP5  S 401 (-3.8A)
EP5  S 401 ( 4.0A)
None
EP5  S 401 ( 4.9A)
 0.58A 6drxA-6g79S:
28.9		 6drxA-6g79S:
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.
6gii CYTOCHROME P450

(Tepidiphilus
thermophilus) 		no annotation 5 LEU A  99
VAL A 103
THR A 105
ALA A  87
PHE A  83
 None
 1.33A 6drxA-6giiA:
undetectable		 6drxA-6giiA:
undetectable