SIMILAR PATTERNS OF AMINO ACIDS FOR 5XDH_A_DAHA60_1

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.
1b2h PERIPLASMIC
OLIGOPEPTIDE-BINDING
PROTEIN

(Salmonella
enterica) 		PF00496
(SBP_bac_5) 		4 HIS A 161
ASN A 428
LEU A 100
GLN A 114
 None
 1.41A 5xdhA-1b2hA:
0.1
5xdhC-1b2hA:
undetectable		 5xdhA-1b2hA:
8.55
5xdhC-1b2hA:
8.55
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.
1e4w TAB2

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 MET H  80
ASN H  76
VAL H  71
LEU H  69
 None
 1.29A 5xdhA-1e4wH:
undetectable
5xdhC-1e4wH:
undetectable		 5xdhA-1e4wH:
16.58
5xdhC-1e4wH:
16.58
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.
1h0h FORMATE
DEHYDROGENASE
SUBUNIT BETA

(Desulfovibrio
gigas) 		PF13247
(Fer4_11) 		4 HIS B  55
ASN B  40
VAL B  52
GLN B  18
 None
None
SF4  B1011 ( 4.9A)
None
 1.30A 5xdhA-1h0hB:
undetectable
5xdhC-1h0hB:
undetectable		 5xdhA-1h0hB:
24.07
5xdhC-1h0hB:
24.07
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.
1huq RAB5C

(Mus musculus) 		PF00071
(Ras) 		4 ASN A 172
VAL A  42
LEU A  39
GLN A  61
 None
 1.43A 5xdhA-1huqA:
undetectable
5xdhC-1huqA:
undetectable		 5xdhA-1huqA:
20.38
5xdhC-1huqA:
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.
1lb3 FERRITIN LIGHT CHAIN
1

(Mus musculus) 		PF00210
(Ferritin) 		4 HIS A  27
ASN A 109
LEU A 133
GLN A 112
 None
 1.45A 5xdhA-1lb3A:
0.2
5xdhC-1lb3A:
undetectable		 5xdhA-1lb3A:
19.48
5xdhC-1lb3A:
19.48
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.
1oah CYTOCHROME C NITRITE
REDUCTASE

(Desulfovibrio
desulfuricans) 		PF02335
(Cytochrom_C552) 		4 HIS A 335
ASN A 190
VAL A 229
GLN A 232
 HEM  A1521 (-3.2A)
HEM  A1522 ( 4.1A)
None
HEM  A1522 ( 4.7A)
 1.30A 5xdhA-1oahA:
undetectable
5xdhC-1oahA:
undetectable		 5xdhA-1oahA:
10.16
5xdhC-1oahA:
10.16
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.
1qyc PHENYLCOUMARAN
BENZYLIC ETHER
REDUCTASE PT1

(Pinus taeda) 		PF05368
(NmrA) 		4 ASN A 278
VAL A 187
LEU A 222
GLN A 276
 None
 1.50A 5xdhA-1qycA:
0.0
5xdhC-1qycA:
0.0		 5xdhA-1qycA:
12.70
5xdhC-1qycA:
12.70
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.
1sqj OLIGOXYLOGLUCAN
REDUCING-END-SPECIFI
C CELLOBIOHYDROLASE

(Geotrichum sp.
M128) 		PF15899
(BNR_6) 		4 MET A 138
ASN A 132
VAL A 128
LEU A 126
 None
 1.21A 5xdhA-1sqjA:
undetectable
5xdhC-1sqjA:
undetectable		 5xdhA-1sqjA:
6.96
5xdhC-1sqjA:
6.96
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.
1sqj OLIGOXYLOGLUCAN
REDUCING-END-SPECIFI
C CELLOBIOHYDROLASE

(Geotrichum sp.
M128) 		PF15899
(BNR_6) 		4 MET A 138
ASN A 134
VAL A 128
LEU A 126
 None
 0.95A 5xdhA-1sqjA:
undetectable
5xdhC-1sqjA:
undetectable		 5xdhA-1sqjA:
6.96
5xdhC-1sqjA:
6.96
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.
1t04 HUZAF ANTIBODY HEAVY
CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 MET B  81
ASN B  77
VAL B  72
LEU B  70
 None
 1.19A 5xdhA-1t04B:
undetectable
5xdhC-1t04B:
undetectable		 5xdhA-1t04B:
16.57
5xdhC-1t04B:
16.57
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.
1uc4 DIOL DEHYDRASE ALPHA
SUBUNIT

(Klebsiella
oxytoca) 		PF02286
(Dehydratase_LU) 		4 HIS A 216
MET A 426
ASN A 465
LEU A 428
 None
 1.37A 5xdhA-1uc4A:
0.0
5xdhC-1uc4A:
0.0		 5xdhA-1uc4A:
10.91
5xdhC-1uc4A:
10.91
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.
1ukc ESTA

(Aspergillus
niger) 		PF00135
(COesterase) 		4 MET A 515
ASN A 511
LEU A 506
GLN A 509
 None
NAG  A1801 ( 2.0A)
None
None
 1.36A 5xdhA-1ukcA:
0.8
5xdhC-1ukcA:
0.0		 5xdhA-1ukcA:
10.00
5xdhC-1ukcA:
10.00
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.
1zi7 KES1 PROTEIN

(Saccharomyces
cerevisiae) 		PF01237
(Oxysterol_BP) 		4 HIS A 418
MET A 186
ASN A 165
LEU A 195
 None
 1.46A 5xdhA-1zi7A:
undetectable
5xdhC-1zi7A:
undetectable		 5xdhA-1zi7A:
11.85
5xdhC-1zi7A:
11.85
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.
2a22 VACUOLAR PROTEIN
SORTING 29

(Cryptosporidium
parvum) 		PF12850
(Metallophos_2) 		4 MET A 168
ASN A  61
VAL A  40
LEU A  11
 None
 1.07A 5xdhA-2a22A:
undetectable
5xdhC-2a22A:
undetectable		 5xdhA-2a22A:
18.18
5xdhC-2a22A:
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.
2bun APPA

(Rhodobacter
sphaeroides) 		PF04940
(BLUF) 		4 ASN A  45
VAL A  38
LEU A  34
GLN A  42
 FAD  A1126 (-2.3A)
None
None
None
 1.50A 5xdhA-2bunA:
undetectable
5xdhC-2bunA:
undetectable		 5xdhA-2bunA:
16.53
5xdhC-2bunA:
16.53
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.
2crm FIBRONECTIN TYPE-III
DOMAIN CONTAINING
PROTEIN 3A

(Homo sapiens) 		PF00041
(fn3) 		4 HIS A  77
MET A  57
VAL A  92
LEU A  90
 None
 1.22A 5xdhA-2crmA:
undetectable
5xdhC-2crmA:
undetectable		 5xdhA-2crmA:
23.48
5xdhC-2crmA:
23.48
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.
2csu 457AA LONG
HYPOTHETICAL PROTEIN

(Pyrococcus
horikoshii) 		PF13380
(CoA_binding_2)
PF13607
(Succ_CoA_lig) 		4 MET A 347
ASN A 343
VAL A 341
LEU A 335
 None
 0.96A 5xdhA-2csuA:
undetectable
5xdhC-2csuA:
undetectable		 5xdhA-2csuA:
11.24
5xdhC-2csuA:
11.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2gje MITOCHONDRIAL
RNA-BINDING PROTEIN
2

(Trypanosoma
brucei) 		PF09387
(MRP) 		4 HIS A  79
MET A 204
ASN A 159
VAL A 199
 None
 1.06A 5xdhA-2gjeA:
undetectable
5xdhC-2gjeA:
undetectable		 5xdhA-2gjeA:
19.80
5xdhC-2gjeA:
19.80
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.
2i7g MONOOXYGENASE

(Agrobacterium
fabrum) 		PF00296
(Bac_luciferase) 		4 HIS A 156
VAL A  91
LEU A 143
GLN A  94
 None
 1.40A 5xdhA-2i7gA:
0.0
5xdhC-2i7gA:
0.0		 5xdhA-2i7gA:
11.73
5xdhC-2i7gA:
11.73
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.
2iu3 BIFUNCTIONAL PURINE
BIOSYNTHESIS PROTEIN
PURH

(Gallus gallus) 		PF01808
(AICARFT_IMPCHas)
PF02142
(MGS) 		4 MET A 368
ASN A 233
VAL A 231
LEU A 229
 None
 1.27A 5xdhA-2iu3A:
undetectable
5xdhC-2iu3A:
undetectable		 5xdhA-2iu3A:
10.08
5xdhC-2iu3A:
10.08
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.
2lec SERINE/ARGININE-RICH
SPLICING FACTOR 2

(Homo sapiens) 		PF00076
(RRM_1) 		4 MET A  89
ASN A  20
VAL A  18
LEU A  16
 None
 1.10A 5xdhA-2lecA:
undetectable
5xdhC-2lecA:
undetectable		 5xdhA-2lecA:
23.44
5xdhC-2lecA:
23.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pk3 GDP-6-DEOXY-D-LYXO-4
-HEXULOSE REDUCTASE

(Aneurinibacillus
thermoaerophilus) 		PF16363
(GDP_Man_Dehyd) 		4 HIS A 164
ASN A  89
VAL A 142
LEU A 134
 None
 1.27A 5xdhA-2pk3A:
0.0
5xdhC-2pk3A:
0.0		 5xdhA-2pk3A:
14.79
5xdhC-2pk3A:
14.79
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.
2pyh POLY(BETA-D-MANNURON
ATE) C5 EPIMERASE 4

(Azotobacter
vinelandii) 		PF12708
(Pectate_lyase_3) 		4 MET A 102
ASN A  99
VAL A  63
LEU A  65
 None
 1.50A 5xdhA-2pyhA:
undetectable
5xdhC-2pyhA:
undetectable		 5xdhA-2pyhA:
11.73
5xdhC-2pyhA:
11.73
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.
2raa PYRUVATE SYNTHASE
SUBUNIT PORC

(Thermotoga
maritima) 		PF01558
(POR) 		4 HIS A  13
ASN A  57
VAL A  75
LEU A  92
 None
 1.30A 5xdhA-2raaA:
0.6
5xdhC-2raaA:
0.0		 5xdhA-2raaA:
18.52
5xdhC-2raaA:
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.
2xf8 D-ERYTHROSE-4-PHOSPH
ATE DEHYDROGENASE

(Escherichia
coli) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		4 HIS A 120
ASN A   6
VAL A 116
LEU A 124
 3CD  A 600 (-4.1A)
3CD  A 600 ( 4.3A)
None
None
 1.47A 5xdhA-2xf8A:
undetectable
5xdhC-2xf8A:
undetectable		 5xdhA-2xf8A:
13.77
5xdhC-2xf8A:
13.77
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.
3au9 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Plasmodium
falciparum) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		4 MET A 464
ASN A 413
LEU A 468
GLN A 454
 None
 1.49A 5xdhA-3au9A:
undetectable
5xdhC-3au9A:
0.0		 5xdhA-3au9A:
10.65
5xdhC-3au9A:
10.65
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.
3bcq BETA-CHAIN
HEMOGLOBIN

(Brycon cephalus) 		PF00042
(Globin) 		4 HIS B  63
MET B  91
ASN B 102
LEU B  88
 OXY  B 148 ( 3.8A)
HEM  B 147 (-4.0A)
None
None
 1.42A 5xdhA-3bcqB:
1.7
5xdhC-3bcqB:
1.5		 5xdhA-3bcqB:
22.54
5xdhC-3bcqB:
22.54
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.
3e2d ALKALINE PHOSPHATASE

(Vibrio sp.
G15-21) 		PF00245
(Alk_phosphatase) 		4 HIS A 490
ASN A 471
VAL A 312
LEU A   8
 None
 0.97A 5xdhA-3e2dA:
undetectable
5xdhC-3e2dA:
undetectable		 5xdhA-3e2dA:
10.39
5xdhC-3e2dA:
10.39
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.
3ehm SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF12741
(SusD-like) 		4 MET A 184
ASN A 197
VAL A 195
GLN A 196
 None
 1.15A 5xdhA-3ehmA:
undetectable
5xdhC-3ehmA:
undetectable		 5xdhA-3ehmA:
10.07
5xdhC-3ehmA:
10.07
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.
3h5c PROTEIN Z-DEPENDENT
PROTEASE INHIBITOR

(Homo sapiens) 		PF00079
(Serpin) 		4 MET A 402
ASN A  76
VAL A  78
LEU A 414
 None
 1.47A 5xdhA-3h5cA:
undetectable
5xdhC-3h5cA:
undetectable		 5xdhA-3h5cA:
9.69
5xdhC-3h5cA:
9.69
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.
3i04 CARBON MONOXIDE
DEHYDROGENASE/ACETYL
-COA SYNTHASE
SUBUNIT ALPHA

(Moorella
thermoacetica) 		PF03598
(CdhC) 		4 HIS M 516
ASN M 548
LEU M 571
GLN M 549
 SF4  M 900 ( 4.8A)
None
None
None
 1.49A 5xdhA-3i04M:
undetectable
5xdhC-3i04M:
undetectable		 5xdhA-3i04M:
7.27
5xdhC-3i04M:
7.27
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.
3ide CAPSID PROTEIN VP2

(Infectious
pancreatic
necrosis virus) 		PF01766
(Birna_VP2) 		4 HIS A  67
MET A 358
ASN A  71
GLN A  74
 None
 1.23A 5xdhA-3ideA:
undetectable
5xdhC-3ideA:
undetectable		 5xdhA-3ideA:
11.48
5xdhC-3ideA:
11.48
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.
3jwe MGLL PROTEIN

(Homo sapiens) 		PF12146
(Hydrolase_4) 		4 HIS A  59
MET A  98
VAL A  88
GLN A  38
 None
 1.25A 5xdhA-3jweA:
undetectable
5xdhC-3jweA:
undetectable		 5xdhA-3jweA:
18.67
5xdhC-3jweA:
18.67
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.
3kyh MRNA-CAPPING ENZYME
SUBUNIT BETA

(Saccharomyces
cerevisiae) 		PF02940
(mRNA_triPase) 		4 MET A 308
ASN A 342
VAL A 493
LEU A 495
 None
 1.21A 5xdhA-3kyhA:
undetectable
5xdhC-3kyhA:
undetectable		 5xdhA-3kyhA:
12.50
5xdhC-3kyhA:
12.50
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.
3mf9 ENDO-1,4-BETA-XYLANA
SE

(Thermopolyspora
flexuosa) 		PF00457
(Glyco_hydro_11) 		4 HIS A 169
ASN A 165
VAL A  87
GLN A 135
 None
 1.49A 5xdhA-3mf9A:
undetectable
5xdhC-3mf9A:
undetectable		 5xdhA-3mf9A:
15.96
5xdhC-3mf9A:
15.96
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.
3n71 HISTONE LYSINE
METHYLTRANSFERASE
SMYD1

(Mus musculus) 		PF00856
(SET)
PF01753
(zf-MYND) 		4 HIS A 427
MET A 397
ASN A 388
LEU A 437
 None
 1.33A 5xdhA-3n71A:
undetectable
5xdhC-3n71A:
undetectable		 5xdhA-3n71A:
11.06
5xdhC-3n71A:
11.06
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.
3nmz APC VARIANT PROTEIN

(Homo sapiens) 		PF00514
(Arm) 		4 MET A 701
ASN A 709
VAL A 704
LEU A 698
 None
 1.30A 5xdhA-3nmzA:
undetectable
5xdhC-3nmzA:
undetectable		 5xdhA-3nmzA:
9.98
5xdhC-3nmzA:
9.98
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.
3tih HIV-1 CLADE C
ZM109F.PB4 GP120

(Human
immunodeficiency
virus 1) 		PF00516
(GP120) 		4 HIS A 374
ASN A 377
VAL A 255
LEU A 260
 None
 1.32A 5xdhA-3tihA:
undetectable
5xdhC-3tihA:
undetectable		 5xdhA-3tihA:
11.01
5xdhC-3tihA:
11.01
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.
3tjr SHORT CHAIN
DEHYDROGENASE

(Mycobacterium
avium) 		PF00106
(adh_short) 		4 MET A  74
VAL A  65
LEU A  77
GLN A  44
 None
 1.37A 5xdhA-3tjrA:
undetectable
5xdhC-3tjrA:
undetectable		 5xdhA-3tjrA:
13.24
5xdhC-3tjrA:
13.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3vbj GALACTOSIDE
O-ACETYLTRANSFERASE

(Bacillus cereus) 		PF00132
(Hexapep) 		4 MET A  77
ASN A 135
VAL A 137
LEU A 120
 None
 1.35A 5xdhA-3vbjA:
undetectable
5xdhC-3vbjA:
undetectable		 5xdhA-3vbjA:
16.92
5xdhC-3vbjA:
16.92
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.
3wbh ALKALINE PHOSPHATASE

(Halomonas sp.
#593) 		PF00245
(Alk_phosphatase) 		4 HIS A 486
ASN A 467
VAL A 308
LEU A   8
 None
 1.02A 5xdhA-3wbhA:
undetectable
5xdhC-3wbhA:
undetectable		 5xdhA-3wbhA:
10.06
5xdhC-3wbhA:
10.06
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.
3wtr UNCHARACTERIZED
PROTEIN

(Escherichia
coli) 		PF04315
(EpmC) 		4 HIS A   5
VAL A 110
LEU A 161
GLN A 174
 None
 1.34A 5xdhA-3wtrA:
undetectable
5xdhC-3wtrA:
undetectable		 5xdhA-3wtrA:
17.58
5xdhC-3wtrA:
17.58
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.
4bbm CYCLIN-DEPENDENT
KINASE-LIKE 2

(Homo sapiens) 		PF00069
(Pkinase) 		4 ASN A 112
VAL A 140
LEU A 133
GLN A 109
 None
None
TC0  A 500 (-4.3A)
None
 1.22A 5xdhA-4bbmA:
undetectable
5xdhC-4bbmA:
0.1		 5xdhA-4bbmA:
14.83
5xdhC-4bbmA:
14.83
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.
4ecf ABC-TYPE PHOSPHATE
TRANSPORT SYSTEM,
PERIPLASMIC
COMPONENT

(Lactobacillus
brevis) 		PF12849
(PBP_like_2) 		4 ASN A 263
VAL A 266
LEU A 269
GLN A 262
 None
 1.35A 5xdhA-4ecfA:
undetectable
5xdhC-4ecfA:
undetectable		 5xdhA-4ecfA:
12.80
5xdhC-4ecfA:
12.80
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.
4glx DNA LIGASE

(Escherichia
coli) 		PF01653
(DNA_ligase_aden)
PF03119
(DNA_ligase_ZBD)
PF03120
(DNA_ligase_OB)
PF12826
(HHH_2)
PF14520
(HHH_5) 		4 ASN A 495
VAL A 497
LEU A 477
GLN A 494
 None
 1.32A 5xdhA-4glxA:
undetectable
5xdhC-4glxA:
undetectable		 5xdhA-4glxA:
9.84
5xdhC-4glxA:
9.84
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.
4hne PHOSPHATIDYLINOSITOL
4-KINASE TYPE
2-ALPHA

(Homo sapiens) 		PF00454
(PI3_PI4_kinase) 		4 ASN A 206
VAL A 342
LEU A 315
GLN A 293
 ASN  A 206 ( 0.6A)
VAL  A 342 ( 0.5A)
LEU  A 315 ( 0.5A)
GLN  A 293 ( 0.6A)
 1.07A 5xdhA-4hneA:
undetectable
5xdhC-4hneA:
undetectable		 5xdhA-4hneA:
11.94
5xdhC-4hneA:
11.94
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.
4hrt HEMOGLOBIN B CHAIN

(Scapharca
inaequivalvis) 		PF00042
(Globin) 		4 ASN B  81
VAL B  83
LEU B  20
GLN B  80
 None
 1.45A 5xdhA-4hrtB:
1.3
5xdhC-4hrtB:
1.6		 5xdhA-4hrtB:
18.00
5xdhC-4hrtB:
18.00
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.
4i5j SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
REGULATORY SUBUNIT
B'' SUBUNIT ALPHA

(Homo sapiens) 		PF13499
(EF-hand_7) 		4 HIS A 443
MET A 426
ASN A 436
LEU A 407
 None
 1.34A 5xdhA-4i5jA:
undetectable
5xdhC-4i5jA:
undetectable		 5xdhA-4i5jA:
16.16
5xdhC-4i5jA:
16.16
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.
4ine PROTEIN PMT-2

(Caenorhabditis
elegans) 		PF08241
(Methyltransf_11) 		4 HIS A  53
ASN A  49
VAL A  26
LEU A  68
 None
 1.44A 5xdhA-4ineA:
undetectable
5xdhC-4ineA:
undetectable		 5xdhA-4ineA:
10.67
5xdhC-4ineA:
10.67
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.
4isc METHYLTRANSFERASE

(Pseudomonas
syringae group
genomosp. 3) 		PF05401
(NodS) 		4 HIS A 144
ASN A  53
VAL A 110
LEU A 140
 None
 1.45A 5xdhA-4iscA:
undetectable
5xdhC-4iscA:
undetectable		 5xdhA-4iscA:
17.65
5xdhC-4iscA:
17.65
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.
4j5t MANNOSYL-OLIGOSACCHA
RIDE GLUCOSIDASE

(Saccharomyces
cerevisiae) 		PF03200
(Glyco_hydro_63)
PF16923
(Glyco_hydro_63N) 		4 HIS A 195
ASN A 250
LEU A 139
GLN A 199
 None
 1.46A 5xdhA-4j5tA:
undetectable
5xdhC-4j5tA:
undetectable		 5xdhA-4j5tA:
7.16
5xdhC-4j5tA:
7.16
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.
4jdu AEROTOLERANCE-RELATE
D MEMBRANE PROTEIN

(Bacteroides
fragilis) 		PF00092
(VWA) 		4 MET A 133
ASN A 221
VAL A 195
LEU A  96
 None
 1.40A 5xdhA-4jduA:
undetectable
5xdhC-4jduA:
undetectable		 5xdhA-4jduA:
17.79
5xdhC-4jduA:
17.79
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.
4l1d SODIUM CHANNEL
SUBUNIT BETA-3

(Homo sapiens) 		PF07686
(V-set) 		4 HIS A  57
ASN A  71
VAL A  79
LEU A  76
 None
 1.43A 5xdhA-4l1dA:
undetectable
5xdhC-4l1dA:
undetectable		 5xdhA-4l1dA:
21.09
5xdhC-4l1dA:
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.
4l1f ACYL-COA
DEHYDROGENASE DOMAIN
PROTEIN

(Acidaminococcus
fermentans) 		PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N) 		4 HIS A 301
MET A   1
ASN A 307
GLN A   9
 None
 1.16A 5xdhA-4l1fA:
undetectable
5xdhC-4l1fA:
undetectable		 5xdhA-4l1fA:
12.37
5xdhC-4l1fA:
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.
4oby ARGININE--TRNA
LIGASE

(Escherichia
coli) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		4 MET A 449
VAL A 424
LEU A 450
GLN A 461
 None
 1.47A 5xdhA-4obyA:
undetectable
5xdhC-4obyA:
undetectable		 5xdhA-4obyA:
8.52
5xdhC-4obyA:
8.52
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.
4ofz TREHALOSE-PHOSPHATAS
E

(Brugia malayi) 		no annotation 4 HIS A 347
ASN A 355
VAL A 342
LEU A 383
 None
 1.49A 5xdhA-4ofzA:
undetectable
5xdhC-4ofzA:
undetectable		 5xdhA-4ofzA:
9.11
5xdhC-4ofzA:
9.11
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.
4oya ADENYLATE CYCLASE
TYPE 10

(Homo sapiens) 		PF00211
(Guanylate_cyc) 		4 HIS A  19
ASN A 333
LEU A 274
GLN A 331
 None
None
None
GOL  A 502 (-3.7A)
 1.44A 5xdhA-4oyaA:
undetectable
5xdhC-4oyaA:
undetectable		 5xdhA-4oyaA:
12.86
5xdhC-4oyaA:
12.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pbq PUTATIVE TRAP
PERIPLASMIC SOLUTE
BINDING PROTEIN

(Haemophilus
influenzae) 		PF03480
(DctP) 		4 HIS A 230
ASN A 172
VAL A 169
LEU A 167
 None
2UF  A 401 (-3.9A)
None
None
 1.34A 5xdhA-4pbqA:
undetectable
5xdhC-4pbqA:
undetectable		 5xdhA-4pbqA:
14.98
5xdhC-4pbqA:
14.98
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.
4pfb C4-DICARBOXYLATE-BIN
DING PROTEIN

(Fusobacterium
nucleatum) 		PF03480
(DctP) 		4 MET A 319
ASN A 101
VAL A 103
LEU A 322
 None
 1.35A 5xdhA-4pfbA:
undetectable
5xdhC-4pfbA:
undetectable		 5xdhA-4pfbA:
17.83
5xdhC-4pfbA:
17.83
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.
4pj3 INTRON-BINDING
PROTEIN AQUARIUS

(Homo sapiens) 		PF13086
(AAA_11)
PF13087
(AAA_12)
PF16399
(Aquarius_N) 		4 HIS A 330
ASN A 355
VAL A 359
LEU A 365
 None
 1.41A 5xdhA-4pj3A:
undetectable
5xdhC-4pj3A:
undetectable		 5xdhA-4pj3A:
4.98
5xdhC-4pj3A:
4.98
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.
4qhb UNCHARACTERIZED
PROTEIN

(Bacteroides
vulgatus) 		PF09112
(N-glycanase_N)
PF09113
(N-glycanase_C) 		4 MET A 117
ASN A 246
LEU A  65
GLN A 253
 None
 1.45A 5xdhA-4qhbA:
undetectable
5xdhC-4qhbA:
undetectable		 5xdhA-4qhbA:
13.52
5xdhC-4qhbA:
13.52
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.
4rkm MCCA

(Wolinella
succinogenes) 		no annotation 4 HIS A  74
MET A 293
VAL A  90
LEU A  88
 None
 1.06A 5xdhA-4rkmA:
undetectable
5xdhC-4rkmA:
undetectable		 5xdhA-4rkmA:
8.91
5xdhC-4rkmA:
8.91
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.
4ryb 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Neisseria
meningitidis) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 HIS A 247
VAL A 113
LEU A 191
GLN A 111
 None
 1.37A 5xdhA-4rybA:
undetectable
5xdhC-4rybA:
undetectable		 5xdhA-4rybA:
14.73
5xdhC-4rybA:
14.73
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.
4wzi CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B

(Homo sapiens) 		PF00233
(PDEase_I) 		4 HIS A 400
VAL A 453
LEU A 475
GLN A 589
 None
 1.49A 5xdhA-4wziA:
undetectable
5xdhC-4wziA:
undetectable		 5xdhA-4wziA:
8.59
5xdhC-4wziA:
8.59
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.
4x0o 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3 PROTEIN 2

(Vibrio cholerae) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		4 HIS A  49
VAL A  58
LEU A  55
GLN A  61
 None
 1.45A 5xdhA-4x0oA:
undetectable
5xdhC-4x0oA:
undetectable		 5xdhA-4x0oA:
12.68
5xdhC-4x0oA:
12.68
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.
4xzw ENDO-GLUCANASE
CHIMERA C10

(Geobacillus sp.
70PC53;
uncultured
bacterium) 		PF00150
(Cellulase) 		4 MET A  65
ASN A  45
LEU A  81
GLN A  42
 None
 1.45A 5xdhA-4xzwA:
undetectable
5xdhC-4xzwA:
undetectable		 5xdhA-4xzwA:
13.95
5xdhC-4xzwA:
13.95
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.
4y67 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE,
APICOPLAST

(Plasmodium
falciparum) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		4 MET A 464
ASN A 413
LEU A 468
GLN A 454
 None
 1.47A 5xdhA-4y67A:
undetectable
5xdhC-4y67A:
undetectable		 5xdhA-4y67A:
10.81
5xdhC-4y67A:
10.81
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.
4z81 EGF FAMILY
DOMAIN-CONTAINING
PROTEIN

(Toxoplasma
gondii) 		PF02430
(AMA-1)
PF07974
(EGF_2) 		4 HIS A 456
ASN A 149
VAL A 110
GLN A 349
 None
 1.44A 5xdhA-4z81A:
undetectable
5xdhC-4z81A:
undetectable		 5xdhA-4z81A:
9.84
5xdhC-4z81A:
9.84
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.
5a9i SOLUTE CARRIER
FAMILY 15 MEMBER 2

(Rattus
norvegicus) 		no annotation 4 HIS A 451
ASN A 420
VAL A 428
LEU A 439
 None
 1.50A 5xdhA-5a9iA:
undetectable
5xdhC-5a9iA:
undetectable		 5xdhA-5a9iA:
19.68
5xdhC-5a9iA:
19.68
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.
5b6k UNCHARACTERIZED
PROTEIN CGKR1

([Candida]
glabrata) 		PF01370
(Epimerase) 		4 HIS A  46
ASN A 214
VAL A 216
GLN A 343
 None
 1.29A 5xdhA-5b6kA:
undetectable
5xdhC-5b6kA:
undetectable		 5xdhA-5b6kA:
11.97
5xdhC-5b6kA:
11.97
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.
5c6g AGR133CP
SISTER CHROMATID
COHESION PROTEIN 2

(Eremothecium
gossypii) 		PF10345
(Cohesin_load)
no annotation 		4 HIS B  26
ASN A 510
LEU A 519
GLN A 547
 None
 1.01A 5xdhA-5c6gB:
undetectable
5xdhC-5c6gB:
undetectable		 5xdhA-5c6gB:
16.50
5xdhC-5c6gB:
16.50
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.
5d3o GLUTAMINASE KIDNEY
ISOFORM,
MITOCHONDRIAL

(Homo sapiens) 		PF04960
(Glutaminase) 		4 MET A 504
ASN A 441
VAL A 496
LEU A 494
 None
 1.38A 5xdhA-5d3oA:
undetectable
5xdhC-5d3oA:
undetectable		 5xdhA-5d3oA:
10.40
5xdhC-5d3oA:
10.40
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.
5dxx ARTEMISINIC ALDEHYDE
DELTA(11(13))
REDUCTASE

(Artemisia annua) 		PF00724
(Oxidored_FMN) 		4 HIS A  20
ASN A  17
VAL A  97
LEU A  55
 None
 1.32A 5xdhA-5dxxA:
undetectable
5xdhC-5dxxA:
undetectable		 5xdhA-5dxxA:
10.59
5xdhC-5dxxA:
10.59
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.
5exr DNA POLYMERASE ALPHA
SUBUNIT B

(Homo sapiens) 		PF04042
(DNA_pol_E_B)
PF08418
(Pol_alpha_B_N) 		4 HIS D 431
VAL D 456
LEU D 202
GLN D 454
 None
 1.27A 5xdhA-5exrD:
undetectable
5xdhC-5exrD:
undetectable		 5xdhA-5exrD:
9.08
5xdhC-5exrD:
9.08
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.
5h1a ICLR TRANSCRIPTION
FACTOR HOMOLOG

(Microbacterium
sp.) 		PF01614
(IclR)
PF09339
(HTH_IclR) 		4 HIS A 138
ASN A 111
VAL A 113
LEU A 135
 None
 1.21A 5xdhA-5h1aA:
undetectable
5xdhC-5h1aA:
undetectable		 5xdhA-5h1aA:
15.18
5xdhC-5h1aA:
15.18
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.
5hsg PUTATIVE ABC
TRANSPORTER,
NUCLEOTIDE
BINDING/ATPASE
PROTEIN

(Klebsiella
pneumoniae) 		PF13407
(Peripla_BP_4) 		4 ASN A  69
VAL A  38
LEU A  93
GLN A  77
 None
 1.30A 5xdhA-5hsgA:
undetectable
5xdhC-5hsgA:
undetectable		 5xdhA-5hsgA:
16.90
5xdhC-5hsgA:
16.90
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.
5ip7 DNA-DIRECTED RNA
POLYMERASE II
SUBUNIT RPB3

(Saccharomyces
cerevisiae) 		PF01000
(RNA_pol_A_bac)
PF01193
(RNA_pol_L) 		4 HIS C 131
ASN C 123
VAL C 121
LEU C  99
 None
 1.38A 5xdhA-5ip7C:
undetectable
5xdhC-5ip7C:
undetectable		 5xdhA-5ip7C:
12.98
5xdhC-5ip7C:
12.98
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.
5jjp NONRIBOSOMAL PEPTIDE
SYNTHASE

(Streptomyces
sp. MJ635-86F5) 		PF00501
(AMP-binding) 		4 HIS A 343
MET A 348
LEU A 369
GLN A 400
 None
 1.25A 5xdhA-5jjpA:
undetectable
5xdhC-5jjpA:
undetectable		 5xdhA-5jjpA:
10.02
5xdhC-5jjpA:
10.02
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.
5jjq AMP-DEPENDENT
SYNTHETASE AND
LIGASE

(Streptomyces
sp. ML694-90F3) 		PF00501
(AMP-binding)
PF13193
(AMP-binding_C) 		4 HIS A 344
MET A 349
LEU A 370
GLN A 401
 None
 1.29A 5xdhA-5jjqA:
undetectable
5xdhC-5jjqA:
undetectable		 5xdhA-5jjqA:
10.50
5xdhC-5jjqA:
10.50
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.
5jm6 AMINOPEPTIDASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF02127
(Peptidase_M18) 		4 ASN A 447
VAL A 414
LEU A 494
GLN A 448
 None
 1.46A 5xdhA-5jm6A:
undetectable
5xdhC-5jm6A:
undetectable		 5xdhA-5jm6A:
13.25
5xdhC-5jm6A:
13.25
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.
5jqk PEPTIDASE, PUTATIVE

(Plasmodium
falciparum) 		PF00557
(Peptidase_M24)
PF01321
(Creatinase_N)
PF16188
(Peptidase_M24_C)
PF16189
(Creatinase_N_2) 		4 MET A 671
ASN A 651
VAL A 646
LEU A 673
 None
 1.13A 5xdhA-5jqkA:
undetectable
5xdhC-5jqkA:
undetectable		 5xdhA-5jqkA:
8.57
5xdhC-5jqkA:
8.57
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.
5lcw ANAPHASE-PROMOTING
COMPLEX SUBUNIT 1

(Homo sapiens) 		PF12859
(ANAPC1) 		4 HIS A  31
VAL A 119
LEU A  35
GLN A 155
 None
 1.31A 5xdhA-5lcwA:
undetectable
5xdhC-5lcwA:
undetectable		 5xdhA-5lcwA:
3.44
5xdhC-5lcwA:
3.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5lgc ARCE4A

(Arthrobacter
sp. AW19M34-1) 		PF01522
(Polysacc_deac_1) 		4 HIS A 191
VAL A 198
LEU A  29
GLN A 202
 None
 0.92A 5xdhA-5lgcA:
undetectable
5xdhC-5lgcA:
undetectable		 5xdhA-5lgcA:
20.00
5xdhC-5lgcA:
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.
5m8j DIVALENT METAL
CATION TRANSPORTER
MNTH

(Eremococcus
coleocola) 		PF01566
(Nramp) 		4 ASN A 405
VAL A 408
LEU A 120
GLN A 463
 None
 1.15A 5xdhA-5m8jA:
0.2
5xdhC-5m8jA:
0.1		 5xdhA-5m8jA:
9.44
5xdhC-5m8jA:
9.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5o82 INTRACELLULAR
EXO-ALPHA-(1->5)-L-A
RABINOFURANOSIDASE

(Chaetomium
thermophilum) 		no annotation 4 HIS A 157
ASN A 103
VAL A  86
GLN A 104
 None
 1.11A 5xdhA-5o82A:
undetectable
5xdhC-5o82A:
undetectable		 5xdhA-5o82A:
18.07
5xdhC-5o82A:
18.07
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.
5ohj CAMP-SPECIFIC
3',5'-CYCLIC
PHOSPHODIESTERASE 4B

(Homo sapiens) 		no annotation 4 HIS A 400
VAL A 453
LEU A 475
GLN A 589
 None
None
None
9VE  A 801 (-3.4A)
 1.41A 5xdhA-5ohjA:
undetectable
5xdhC-5ohjA:
0.0		 5xdhA-5ohjA:
18.48
5xdhC-5ohjA:
18.48
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.
5sui RIBOSOME BIOGENESIS
PROTEIN NSA1

(Saccharomyces
cerevisiae) 		no annotation 4 MET A 414
ASN A 410
VAL A  10
LEU A   8
 None
 1.41A 5xdhA-5suiA:
undetectable
5xdhC-5suiA:
undetectable		 5xdhA-5suiA:
10.25
5xdhC-5suiA:
10.25
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.
5tud ANTI-5-HT2B FAB
HEAVY CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 MET C  81
ASN C  77
VAL C  72
LEU C  70
 None
 1.17A 5xdhA-5tudC:
undetectable
5xdhC-5tudC:
undetectable		 5xdhA-5tudC:
16.11
5xdhC-5tudC:
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.
5tus RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE
LARGE SUBUNIT

(Homo sapiens) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC)
PF03477
(ATP-cone) 		4 HIS A 179
ASN A 478
VAL A 473
LEU A 192
 None
 1.34A 5xdhA-5tusA:
undetectable
5xdhC-5tusA:
undetectable		 5xdhA-5tusA:
9.02
5xdhC-5tusA:
9.02
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.
5u87 PREPROALBUMIN PAWS1

(Helianthus
annuus) 		PF00234
(Tryp_alpha_amyl) 		4 ASN A  30
VAL A  78
LEU A 106
GLN A  81
 None
 1.29A 5xdhA-5u87A:
undetectable
5xdhC-5u87A:
undetectable		 5xdhA-5u87A:
18.18
5xdhC-5u87A:
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.
5vcs ALPHA-1,6-MANNOSYL-G
LYCOPROTEIN
2-BETA-N-ACETYLGLUCO
SAMINYLTRANSFERASE

(Homo sapiens) 		no annotation 4 HIS A 239
ASN A  99
VAL A 245
GLN A 102
 None
 1.34A 5xdhA-5vcsA:
undetectable
5xdhC-5vcsA:
undetectable		 5xdhA-5vcsA:
21.35
5xdhC-5vcsA:
21.35
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.
5yks SNF-RELATED
SERINE/THREONINE-PRO
TEIN KINASE

(Homo sapiens) 		no annotation 4 HIS A 137
MET A  67
ASN A  74
VAL A  76
 None
 1.48A 5xdhA-5yksA:
undetectable
5xdhC-5yksA:
undetectable		 5xdhA-5yksA:
12.54
5xdhC-5yksA:
12.54
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.
5zb8 PFUENDOQ

(Pyrococcus
furiosus) 		no annotation 4 HIS A  10
ASN A 116
VAL A  77
LEU A  86
 ZN  A 502 (-3.3A)
None
None
None
 1.36A 5xdhA-5zb8A:
undetectable
5xdhC-5zb8A:
undetectable		 5xdhA-5zb8A:
24.18
5xdhC-5zb8A:
24.18
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.
6anr COLIBACTIN
SELF-PROTECTION
PROTEIN CLBS

(Escherichia
coli) 		no annotation 4 HIS A  67
ASN A 149
LEU A 131
GLN A 147
 None
 1.39A 5xdhA-6anrA:
undetectable
5xdhC-6anrA:
undetectable		 5xdhA-6anrA:
18.52
5xdhC-6anrA:
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.
6d6q EXOSOME COMPLEX
EXONUCLEASE RRP44

(Homo sapiens) 		no annotation 4 HIS K 774
VAL K 752
LEU K 817
GLN K 750
 A  O  60 ( 3.3A)
None
None
A  O  57 ( 4.9A)
 1.37A 5xdhA-6d6qK:
undetectable
5xdhC-6d6qK:
undetectable		 5xdhA-6d6qK:
22.45
5xdhC-6d6qK:
22.45
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.
6emk SERINE/THREONINE-PRO
TEIN KINASE TOR2
TARGET OF RAPAMYCIN
COMPLEX SUBUNIT LST8

(Saccharomyces
cerevisiae) 		no annotation 4 HIS B 291
VAL B 296
LEU B  38
GLN A2221
 None
 1.46A 5xdhA-6emkB:
undetectable
5xdhC-6emkB:
undetectable		 5xdhA-6emkB:
20.43
5xdhC-6emkB:
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.
6f1e INTERFERON GAMMA

(Paralichthys
olivaceus) 		no annotation 4 HIS A  40
MET A  85
ASN A  91
LEU A 116
 None
 1.33A 5xdhA-6f1eA:
undetectable
5xdhC-6f1eA:
undetectable		 5xdhA-6f1eA:
21.18
5xdhC-6f1eA:
21.18