SIMILAR PATTERNS OF AMINO ACIDS FOR 2HC4_A_VDXA525_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.
1a80 2,5-DIKETO-D-GLUCONI
C ACID REDUCTASE A

(Corynebacterium
sp.) 		PF00248
(Aldo_ket_red) 		5 PHE A  71
LEU A 104
SER A 135
HIS A 141
LEU A 146
 None
 1.26A 2hc4A-1a80A:
0.0		 2hc4A-1a80A:
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.
1kbl PYRUVATE PHOSPHATE
DIKINASE

([Clostridium]
symbiosum) 		PF00391
(PEP-utilizers)
PF01326
(PPDK_N)
PF02896
(PEP-utilizers_C) 		5 PHE A 136
LEU A 109
VAL A  89
VAL A 237
LEU A  26
 None
 1.40A 2hc4A-1kblA:
0.0		 2hc4A-1kblA:
15.25
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.
1nf3 PAR-6B

(Mus musculus) 		PF00595
(PDZ) 		5 LEU C 216
VAL C 246
SER C 178
VAL C 231
LEU C 242
 LEU  C 216 ( 0.6A)
VAL  C 246 ( 0.6A)
SER  C 178 ( 0.0A)
VAL  C 231 ( 0.6A)
LEU  C 242 ( 0.6A)
 1.17A 2hc4A-1nf3C:
undetectable		 2hc4A-1nf3C:
18.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1p3w CYSTEINE DESULFURASE

(Escherichia
coli) 		no annotation 5 LEU B 372
VAL B 373
SER B 376
VAL B 322
LEU B 301
 None
 1.40A 2hc4A-1p3wB:
0.0		 2hc4A-1p3wB:
21.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1pcg ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 PHE A 404
LEU A 391
VAL A 392
SER A 395
LEU A 511
 EST  A   1 (-4.9A)
EST  A   1 ( 3.9A)
None
None
None
 1.29A 2hc4A-1pcgA:
23.4		 2hc4A-1pcgA:
25.93
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.
1sp8 4-HYDROXYPHENYLPYRUV
ATE DIOXYGENASE

(Zea mays) 		PF00903
(Glyoxalase) 		5 PHE A 234
LEU A 272
VAL A  52
LEU A  97
LEU A 386
 None
 1.40A 2hc4A-1sp8A:
undetectable		 2hc4A-1sp8A:
22.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xl3 PROTEIN TYPE A
SECRETION CONTROL
PROTEIN

(Yersinia pestis) 		PF07201
(HrpJ)
PF09059
(TyeA) 		5 VAL A 271
SER A 270
VAL C  16
LEU C  70
LEU C  48
 None
None
None
MLY  C  49 ( 4.7A)
MLY  C  49 ( 3.8A)
 1.22A 2hc4A-1xl3A:
0.0		 2hc4A-1xl3A:
24.50
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.
1yks GENOME POLYPROTEIN
[CONTAINS:
FLAVIVIRIN PROTEASE
NS3 CATALYTIC
SUBUNIT]

(Yellow fever
virus) 		PF00271
(Helicase_C)
PF07652
(Flavi_DEAD) 		5 PHE A 615
LEU A 546
CYH A 567
VAL A 536
LEU A 529
 None
 1.40A 2hc4A-1yksA:
0.0		 2hc4A-1yksA:
21.97
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.
1yqd SINAPYL ALCOHOL
DEHYDROGENASE

(Populus
tremuloides) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 LEU A 195
CYH A  50
HIS A 259
LEU A 284
LEU A 264
 NAP  A 500 (-3.4A)
ZN  A1000 (-2.3A)
None
None
None
 1.30A 2hc4A-1yqdA:
undetectable		 2hc4A-1yqdA:
21.63
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bnh RIBONUCLEASE
INHIBITOR

(Sus scrofa) 		PF13516
(LRR_6) 		5 LEU A 338
CYH A 308
VAL A 328
LEU A 320
LEU A 372
 None
 1.39A 2hc4A-2bnhA:
undetectable		 2hc4A-2bnhA:
23.59
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.
2cun PHOSPHOGLYCERATE
KINASE

(Pyrococcus
horikoshii) 		PF00162
(PGK) 		5 PHE A 344
LEU A 356
VAL A 355
SER A 361
LEU A 173
 None
 1.26A 2hc4A-2cunA:
undetectable		 2hc4A-2cunA:
22.20
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.
2gah HETEROTETRAMERIC
SARCOSINE OXIDASE
ALPHA-SUBUNIT
HETEROTETRAMERIC
SARCOSINE OXIDASE
GAMMA-SUBUNIT

(Stenotrophomonas
maltophilia) 		PF01571
(GCV_T)
PF04268
(SoxG)
PF07992
(Pyr_redox_2)
PF08669
(GCV_T_C)
PF13510
(Fer2_4) 		5 LEU C 117
VAL C 115
SER C  44
LEU A 690
LEU A 683
 None
 1.33A 2hc4A-2gahC:
undetectable		 2hc4A-2gahC:
20.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2h21 RIBULOSE-1,5
BISPHOSPHATE
CARBOXYLASE/OXYGENAS
E

(Pisum sativum) 		PF00856
(SET)
PF09273
(Rubis-subs-bind) 		5 VAL A 110
SER A 113
SER A 141
VAL A 234
LEU A 219
 None
 1.15A 2hc4A-2h21A:
undetectable		 2hc4A-2h21A:
21.95
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.
2ix8 ELONGATION FACTOR 3A

(Saccharomyces
cerevisiae) 		PF00005
(ABC_tran) 		5 PHE A1208
LEU A1229
VAL A1226
VAL A1267
LEU A1254
 None
 1.27A 2hc4A-2ix8A:
undetectable		 2hc4A-2ix8A:
15.50
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.
2ix8 ELONGATION FACTOR 3A

(Saccharomyces
cerevisiae) 		PF00005
(ABC_tran) 		5 PHE A1208
VAL A1226
SER A1891
VAL A1267
LEU A1254
 None
 1.29A 2hc4A-2ix8A:
undetectable		 2hc4A-2ix8A:
15.50
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.
2jak SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
56 KDA REGULATORY
SUBUNIT GAMMA
ISOFORM

(Homo sapiens) 		PF01603
(B56) 		5 PHE A 246
LEU A 251
VAL A 272
HIS A 264
LEU A 308
 None
 1.38A 2hc4A-2jakA:
undetectable		 2hc4A-2jakA:
21.57
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2o4j VITAMIN D3 RECEPTOR

(Rattus
norvegicus) 		PF00104
(Hormone_recep) 		6 PHE A 150
LEU A 229
SER A 233
SER A 274
CYH A 284
LEU A 389
 None
VD4  A 500 ( 4.8A)
VD4  A 500 ( 2.8A)
VD4  A 500 ( 2.9A)
VD4  A 500 ( 3.4A)
None
 1.28A 2hc4A-2o4jA:
39.3		 2hc4A-2o4jA:
63.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2o4j VITAMIN D3 RECEPTOR

(Rattus
norvegicus) 		PF00104
(Hormone_recep) 		8 PHE A 153
LEU A 229
VAL A 230
SER A 233
VAL A 296
HIS A 301
LEU A 305
HIS A 393
 None
VD4  A 500 ( 4.8A)
VD4  A 500 ( 4.6A)
VD4  A 500 ( 2.8A)
VD4  A 500 ( 4.4A)
VD4  A 500 ( 3.9A)
None
VD4  A 500 ( 3.9A)
 1.40A 2hc4A-2o4jA:
39.3		 2hc4A-2o4jA:
63.31
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2o4j VITAMIN D3 RECEPTOR

(Rattus
norvegicus) 		PF00104
(Hormone_recep) 		12 TYR A 143
PHE A 150
LEU A 229
VAL A 230
SER A 233
SER A 274
CYH A 284
VAL A 296
HIS A 301
LEU A 305
HIS A 393
LEU A 400
 VD4  A 500 ( 4.7A)
None
VD4  A 500 ( 4.8A)
VD4  A 500 ( 4.6A)
VD4  A 500 ( 2.8A)
VD4  A 500 ( 2.9A)
VD4  A 500 ( 3.4A)
VD4  A 500 ( 4.4A)
VD4  A 500 ( 3.9A)
None
VD4  A 500 ( 3.9A)
VD4  A 500 ( 4.9A)
 0.32A 2hc4A-2o4jA:
39.3		 2hc4A-2o4jA:
63.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ocf ESTROGEN RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 PHE A 404
LEU A 391
VAL A 392
SER A 395
LEU A 511
 None
EST  A 596 ( 4.6A)
None
None
None
 1.28A 2hc4A-2ocfA:
23.6		 2hc4A-2ocfA:
24.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2p0n HYPOTHETICAL PROTEIN
NMB1532

(Neisseria
meningitidis) 		PF01814
(Hemerythrin) 		5 PHE A  11
HIS A  96
LEU A  99
HIS A 136
LEU A  93
 None
MN  A 605 (-3.4A)
None
MN  A 605 ( 3.4A)
None
 1.23A 2hc4A-2p0nA:
undetectable		 2hc4A-2p0nA:
16.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rjn RESPONSE REGULATOR
RECEIVER:METAL-DEPEN
DENT
PHOSPHOHYDROLASE, HD
SUBDOMAIN

(Neptuniibacter
caesariensis) 		PF00072
(Response_reg) 		5 VAL A  83
SER A 104
VAL A  10
LEU A  30
LEU A  23
 None
 1.39A 2hc4A-2rjnA:
undetectable		 2hc4A-2rjnA:
18.81
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.
2uzx HEPATOCYTE GROWTH
FACTOR RECEPTOR

(Homo sapiens) 		PF01403
(Sema)
PF01437
(PSI)
PF01833
(TIG) 		5 LEU B 438
VAL B 437
SER B 360
VAL B 486
LEU B 480
 None
 1.28A 2hc4A-2uzxB:
undetectable		 2hc4A-2uzxB:
17.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2v6j RNA HELICASE

(Kokobera virus) 		PF00271
(Helicase_C)
PF07652
(Flavi_DEAD) 		5 PHE A 423
LEU A 355
CYH A 376
VAL A 345
LEU A 338
 None
 1.38A 2hc4A-2v6jA:
undetectable		 2hc4A-2v6jA:
18.26
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.
2vpk MYONEURIN

(Homo sapiens) 		PF00651
(BTB) 		5 TYR A  53
LEU A 102
VAL A 104
SER A  46
LEU A  87
 None
 1.11A 2hc4A-2vpkA:
undetectable		 2hc4A-2vpkA:
15.61
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.
2wjs LAMININ SUBUNIT
ALPHA-2

(Mus musculus) 		PF00054
(Laminin_G_1) 		5 LEU A2423
VAL A2360
SER A2358
LEU A2372
LEU A2492
 None
 1.23A 2hc4A-2wjsA:
undetectable		 2hc4A-2wjsA:
20.07
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.
2wjv REGULATOR OF
NONSENSE TRANSCRIPTS
1

(Homo sapiens) 		PF04851
(ResIII)
PF09416
(UPF1_Zn_bind)
PF13086
(AAA_11)
PF13087
(AAA_12) 		5 PHE A 558
LEU A 559
VAL A 541
VAL A 527
LEU A 518
 None
 1.37A 2hc4A-2wjvA:
undetectable		 2hc4A-2wjvA:
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.
2yrz INTEGRIN BETA-4

(Homo sapiens) 		PF00041
(fn3) 		5 LEU A  24
VAL A  36
VAL A  87
LEU A  62
LEU A  80
 None
 1.40A 2hc4A-2yrzA:
undetectable		 2hc4A-2yrzA:
14.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3b3d PUTATIVE MORPHINE
DEHYDROGENASE

(Bacillus
subtilis) 		PF00248
(Aldo_ket_red) 		5 PHE A  79
LEU A 112
VAL A 144
LEU A 155
LEU A  89
 None
 1.32A 2hc4A-3b3dA:
undetectable		 2hc4A-3b3dA:
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.
3cih PUTATIVE
ALPHA-RHAMNOSIDASE

(Bacteroides
thetaiotaomicron) 		PF17389
(Bac_rhamnosid6H)
PF17390
(Bac_rhamnosid_C) 		5 TYR A 558
PHE A 526
LEU A 459
VAL A 430
LEU A 421
 None
 1.31A 2hc4A-3cihA:
undetectable		 2hc4A-3cihA:
18.11
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.
3co8 ALANINE RACEMASE

(Oenococcus oeni) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		5 PHE A  81
LEU A 102
VAL A 125
SER A 124
LEU A 144
 None
 1.37A 2hc4A-3co8A:
undetectable		 2hc4A-3co8A:
19.64
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.
3d6n ASPARTATE
CARBAMOYLTRANSFERASE

(Aquifex
aeolicus) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		5 LEU B   4
VAL B 117
SER B 163
VAL B 281
LEU B  59
 None
 1.14A 2hc4A-3d6nB:
undetectable		 2hc4A-3d6nB:
21.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3eli AHA1 DOMAIN PROTEIN

(Ruegeria
pomeroyi) 		PF08327
(AHSA1) 		5 VAL A  67
SER A  55
VAL A  99
LEU A   4
HIS A 128
 None
 1.31A 2hc4A-3eliA:
undetectable		 2hc4A-3eliA:
17.61
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.
3h5c PROTEIN Z-DEPENDENT
PROTEASE INHIBITOR

(Homo sapiens) 		PF00079
(Serpin) 		5 PHE A  79
LEU A 414
SER A  70
VAL A 280
LEU A 304
 None
 1.21A 2hc4A-3h5cA:
undetectable		 2hc4A-3h5cA:
22.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3h6z POLYCOMB PROTEIN
SFMBT

(Drosophila
melanogaster) 		PF02820
(MBT) 		5 LEU A 693
SER A 734
CYH A 730
VAL A 704
LEU A 757
 None
 1.36A 2hc4A-3h6zA:
undetectable		 2hc4A-3h6zA:
20.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hp7 HEMOLYSIN, PUTATIVE

(Streptococcus
thermophilus) 		PF01479
(S4)
PF01728
(FtsJ) 		5 PHE A 136
LEU A 168
VAL A 179
HIS A 243
LEU A  79
 None
 1.40A 2hc4A-3hp7A:
undetectable		 2hc4A-3hp7A:
22.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iqd OCTOPINE
DEHYDROGENASE

(Pecten maximus) 		PF02317
(Octopine_DH) 		5 PHE B  99
LEU B  88
CYH B 125
VAL B  85
HIS B 188
 None
 1.31A 2hc4A-3iqdB:
undetectable		 2hc4A-3iqdB:
21.53
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.
3iv0 SUSD HOMOLOG

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 TYR A 328
PHE A 438
LEU A 455
VAL A 461
CYH A 442
 None
 1.40A 2hc4A-3iv0A:
undetectable		 2hc4A-3iv0A:
21.24
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.
3krt CROTONYL COA
REDUCTASE

(Streptomyces
coelicolor) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 PHE A 370
LEU A 209
VAL A 210
VAL A  82
LEU A 392
 None
 1.20A 2hc4A-3krtA:
undetectable		 2hc4A-3krtA:
20.39
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.
3kvy URIDINE
PHOSPHORYLASE

(Bos taurus) 		PF01048
(PNP_UDP_1) 		5 PHE A 301
VAL A 133
VAL A  57
LEU A 118
LEU A 124
 None
 1.39A 2hc4A-3kvyA:
undetectable		 2hc4A-3kvyA:
21.45
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.
3lda DNA REPAIR PROTEIN
RAD51

(Saccharomyces
cerevisiae) 		PF08423
(Rad51)
PF14520
(HHH_5) 		5 PHE A 360
LEU A 183
VAL A 323
CYH A 370
LEU A 303
 None
 1.38A 2hc4A-3ldaA:
undetectable		 2hc4A-3ldaA:
21.96
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.
3nwy URIDYLATE KINASE

(Mycobacterium
tuberculosis) 		PF00696
(AA_kinase) 		5 VAL A 219
SER A 164
VAL A 181
HIS A 209
LEU A 258
 None
 1.29A 2hc4A-3nwyA:
undetectable		 2hc4A-3nwyA:
24.54
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.
3of7 REGULATOR OF
CHROMOSOME
CONDENSATION

(Saccharomyces
cerevisiae) 		PF00415
(RCC1)
PF13540
(RCC1_2) 		5 LEU A 324
VAL A 296
SER A 342
CYH A 354
VAL A 318
 None
 1.18A 2hc4A-3of7A:
undetectable		 2hc4A-3of7A:
21.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qpf PUTATIVE
UNCHARACTERIZED
PROTEIN

(Streptococcus
pneumoniae) 		PF06824
(Glyco_hydro_125) 		5 PHE A 287
LEU A 226
SER A 229
SER A 217
HIS A 177
 None
 1.33A 2hc4A-3qpfA:
undetectable		 2hc4A-3qpfA:
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.
3tat TYROSINE
AMINOTRANSFERASE

(Escherichia
coli) 		PF00155
(Aminotran_1_2) 		5 PHE A 147
LEU A 187
VAL A 186
SER A 253
LEU A 200
 None
 1.25A 2hc4A-3tatA:
undetectable		 2hc4A-3tatA:
21.10
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.
3tis PROTEIN YRDA

(Escherichia
coli) 		PF00132
(Hexapep) 		5 PHE A  12
LEU A   5
VAL A   4
VAL A  19
LEU A 176
 None
 1.39A 2hc4A-3tisA:
undetectable		 2hc4A-3tisA:
21.69
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.
3top MALTASE-GLUCOAMYLASE
, INTESTINAL

(Homo sapiens) 		PF00088
(Trefoil)
PF01055
(Glyco_hydro_31)
PF16863
(NtCtMGAM_N) 		5 PHE A1677
LEU A1661
VAL A1662
SER A1663
LEU A1622
 None
 1.38A 2hc4A-3topA:
undetectable		 2hc4A-3topA:
15.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wgp VITAMIN D3 RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 PHE A 150
SER A 237
SER A 278
CYH A 288
LEU A 393
 None
ED9  A 501 (-2.7A)
ED9  A 501 (-2.7A)
ED9  A 501 (-3.4A)
None
 1.28A 2hc4A-3wgpA:
37.7		 2hc4A-3wgpA:
64.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wgp VITAMIN D3 RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		7 PHE A 153
LEU A 233
VAL A 234
SER A 237
HIS A 305
LEU A 309
HIS A 397
 None
ED9  A 501 ( 4.3A)
None
ED9  A 501 (-2.7A)
ED9  A 501 (-3.9A)
ED9  A 501 (-4.9A)
ED9  A 501 (-3.9A)
 1.43A 2hc4A-3wgpA:
37.7		 2hc4A-3wgpA:
64.33
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3wgp VITAMIN D3 RECEPTOR

(Homo sapiens) 		PF00104
(Hormone_recep) 		12 TYR A 143
PHE A 150
LEU A 233
VAL A 234
SER A 237
SER A 278
CYH A 288
VAL A 300
HIS A 305
LEU A 309
HIS A 397
LEU A 404
 ED9  A 501 (-3.7A)
None
ED9  A 501 ( 4.3A)
None
ED9  A 501 (-2.7A)
ED9  A 501 (-2.7A)
ED9  A 501 (-3.4A)
ED9  A 501 (-4.5A)
ED9  A 501 (-3.9A)
ED9  A 501 (-4.9A)
ED9  A 501 (-3.9A)
None
 0.28A 2hc4A-3wgpA:
37.7		 2hc4A-3wgpA:
64.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bed HEMOCYANIN KLH1

(Megathura
crenulata) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		5 VAL B3078
HIS B3075
LEU B3109
HIS B3106
LEU B3236
 None
CUO  B9008 (-2.8A)
None
CUO  B9008 (-3.3A)
None
 1.38A 2hc4A-4bedB:
undetectable		 2hc4A-4bedB:
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.
4cak INTEGRIN ALPHA-IIB

(Homo sapiens) 		PF01839
(FG-GAP)
PF08441
(Integrin_alpha2) 		5 LEU A 393
SER A 404
VAL A 298
LEU A 307
LEU A 672
 None
NAG  A3570 (-4.7A)
None
None
None
 1.31A 2hc4A-4cakA:
undetectable		 2hc4A-4cakA:
15.64
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.
4eps HYPOTHETICAL PROTEIN

(Bacteroides
ovatus) 		PF13149
(Mfa_like_1) 		5 PHE A 434
LEU A 420
VAL A 419
CYH A 433
HIS A 379
 GOL  A 618 ( 3.6A)
GOL  A 611 (-3.8A)
None
GOL  A 611 ( 3.7A)
None
 1.40A 2hc4A-4epsA:
undetectable		 2hc4A-4epsA:
19.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f5x RNA-DIRECTED RNA
POLYMERASE

(Rotavirus A) 		PF02123
(RdRP_4)
PF12289
(Rotavirus_VP1) 		5 PHE W 766
LEU W 757
VAL W 756
LEU W  75
LEU W 858
 None
 1.16A 2hc4A-4f5xW:
undetectable		 2hc4A-4f5xW:
15.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4f5x RNA-DIRECTED RNA
POLYMERASE

(Rotavirus A) 		PF02123
(RdRP_4)
PF12289
(Rotavirus_VP1) 		5 PHE W 766
LEU W 757
VAL W 756
LEU W 858
LEU W 791
 None
 1.31A 2hc4A-4f5xW:
undetectable		 2hc4A-4f5xW:
15.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4gud IMIDAZOLE GLYCEROL
PHOSPHATE SYNTHASE
SUBUNIT HISH

(Vibrio cholerae) 		PF00117
(GATase) 		5 VAL A  18
SER A  17
VAL A 182
LEU A 136
LEU A  75
 None
 1.40A 2hc4A-4gudA:
undetectable		 2hc4A-4gudA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k30 N-ACETYLGLUTAMATE
SYNTHASE,
MITOCHONDRIAL

(Homo sapiens) 		PF04768
(NAT) 		5 LEU A 394
VAL A 395
SER A 398
LEU A 430
LEU A 411
 None
 1.11A 2hc4A-4k30A:
undetectable		 2hc4A-4k30A:
19.67
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.
4k3j HEPATOCYTE GROWTH
FACTOR BETA CHAIN

(Homo sapiens) 		PF01403
(Sema)
PF01437
(PSI) 		5 LEU B 438
VAL B 437
SER B 360
VAL B 486
LEU B 480
 None
 1.35A 2hc4A-4k3jB:
undetectable		 2hc4A-4k3jB:
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.
4lls GERANYLTRANSTRANSFER
ASE

(Roseobacter
denitrificans) 		PF00348
(polyprenyl_synt) 		5 LEU A 182
SER A 144
VAL A  48
LEU A 193
LEU A 201
 None
 1.32A 2hc4A-4llsA:
2.3		 2hc4A-4llsA:
19.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4njz HISTIDINE TRIAD
NUCLEOTIDE-BINDING
PROTEIN 2,
MITOCHONDRIAL

(Homo sapiens) 		PF01230
(HIT) 		5 PHE A  56
LEU A  90
SER A 144
LEU A 158
LEU A 127
 None
None
SO4  A 201 (-2.8A)
None
None
 1.18A 2hc4A-4njzA:
undetectable		 2hc4A-4njzA:
18.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4qj4 1-PHOSPHATIDYLINOSIT
OL 4,5-BISPHOSPHATE
PHOSPHODIESTERASE
BETA-3

(Homo sapiens) 		PF00168
(C2)
PF00387
(PI-PLC-Y)
PF00388
(PI-PLC-X)
PF09279
(EF-hand_like) 		5 TYR B 326
LEU B 315
SER B 696
LEU B 308
LEU B 143
 None
 1.36A 2hc4A-4qj4B:
undetectable		 2hc4A-4qj4B:
17.00
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.
4rh7 GREEN FLUORESCENT
PROTEIN/CYTOPLASMIC
DYNEIN 2 HEAVY CHAIN
1

(Homo sapiens;
synthetic
construct) 		PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9) 		5 PHE A4031
SER A4116
HIS A2415
LEU A2366
LEU A2363
 None
 1.34A 2hc4A-4rh7A:
undetectable		 2hc4A-4rh7A:
6.59
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.
4upe NICKEL-DEPENDENT
HYDROGENASE LARGE
SUBUNIT

(Desulfovibrio
fructosivorans) 		PF00374
(NiFeSe_Hases) 		5 PHE Q 390
LEU Q 386
SER Q 420
HIS Q 118
HIS Q 123
 None
 1.15A 2hc4A-4upeQ:
undetectable		 2hc4A-4upeQ:
19.64
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.
4yu9 GLUTAMINYL-PEPTIDE
CYCLOTRANSFERASE

(Homo sapiens) 		PF04389
(Peptidase_M28) 		5 PHE A 197
LEU A 195
VAL A 355
LEU A 361
LEU A 191
 None
 0.92A 2hc4A-4yu9A:
undetectable		 2hc4A-4yu9A:
21.68
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.
5a31 ANAPHASE-PROMOTING
COMPLEX SUBUNIT 5

(Homo sapiens) 		PF12862
(ANAPC5) 		5 PHE O 112
LEU O  38
VAL O  37
VAL O 132
LEU O  60
 None
 1.38A 2hc4A-5a31O:
undetectable		 2hc4A-5a31O:
17.24
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.
5aor DOSAGE COMPENSATION
REGULATOR

(Drosophila
melanogaster) 		PF00270
(DEAD)
PF00271
(Helicase_C)
PF04408
(HA2)
PF07717
(OB_NTP_bind) 		5 LEU A 537
VAL A 506
CYH A 554
LEU A 498
LEU A 491
 None
 1.39A 2hc4A-5aorA:
undetectable		 2hc4A-5aorA:
12.08
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.
5c4t NUCLEAR RECEPTOR
ROR-GAMMA

(Homo sapiens) 		PF00104
(Hormone_recep) 		5 TYR A 420
PHE A 403
VAL A 361
VAL A 480
LEU A 505
 None
None
None
4Y6  A 601 ( 3.8A)
4Y6  A 601 (-4.0A)
 1.14A 2hc4A-5c4tA:
22.9		 2hc4A-5c4tA:
28.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c5g SPHERULIN-4

(Aspergillus
clavatus) 		PF12138
(Spherulin4) 		5 TYR A 198
VAL A  60
SER A 217
VAL A 271
LEU A 264
 None
 1.36A 2hc4A-5c5gA:
undetectable		 2hc4A-5c5gA:
23.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5co1 PROTOCADHERIN-19
ISOFORM 1

(Danio rerio) 		PF00028
(Cadherin) 		5 PHE A 215
LEU A 237
VAL A 274
CYH A 307
VAL A 222
 None
 1.31A 2hc4A-5co1A:
undetectable		 2hc4A-5co1A:
22.90
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.
5dds CRMG

(Actinoalloteichus
sp. WH1-2216-6) 		PF00202
(Aminotran_3) 		5 LEU A 171
VAL A 269
VAL A 182
LEU A 157
LEU A 150
 None
 1.35A 2hc4A-5ddsA:
undetectable		 2hc4A-5ddsA:
20.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dl5 MEMBRANE PROTEIN

(Acinetobacter
baumannii) 		PF03573
(OprD) 		5 PHE A 132
LEU A 120
VAL A 119
SER A 300
VAL A 148
 None
 1.39A 2hc4A-5dl5A:
undetectable		 2hc4A-5dl5A:
21.58
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.
5esy SAL1 PHOSPHATASE

(Arabidopsis
thaliana) 		PF00459
(Inositol_P) 		5 PHE A 192
VAL A 296
SER A 267
CYH A 167
LEU A 311
 None
 1.25A 2hc4A-5esyA:
undetectable		 2hc4A-5esyA:
23.08
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.
5fv4 CARBOXYLIC ESTER
HYDROLASE

(Sus scrofa) 		PF00135
(COesterase) 		5 PHE A 160
LEU A 127
SER A 209
LEU A 340
HIS A 449
 None
 1.37A 2hc4A-5fv4A:
undetectable		 2hc4A-5fv4A:
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.
5g06 EXOSOME COMPLEX
COMPONENT SKI6

(Saccharomyces
cerevisiae) 		PF01138
(RNase_PH)
PF03725
(RNase_PH_C) 		5 PHE B 108
VAL B 189
SER B 197
VAL B 224
LEU B 172
 None
 1.31A 2hc4A-5g06B:
undetectable		 2hc4A-5g06B:
25.42
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.
5gzt CHITINASE

(Paenibacillus
sp. FPU-7) 		PF00704
(Glyco_hydro_18)
no annotation 		5 PHE B 355
VAL B 313
VAL B 296
LEU A 254
LEU A 273
 None
 1.01A 2hc4A-5gztB:
undetectable		 2hc4A-5gztB:
12.96
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.
5ijb TOLL-LIKE RECEPTOR
4, VARIABLE
LYMPHOCYTE RECEPTOR
B CHIMERA

(Eptatretus
burgeri;
Mus musculus) 		PF00560
(LRR_1)
PF11921
(DUF3439)
PF13855
(LRR_8) 		5 PHE A 121
LEU A 130
VAL A 131
VAL A 179
HIS A 178
 None
 1.36A 2hc4A-5ijbA:
undetectable		 2hc4A-5ijbA:
19.70
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.
5iq0 ESTERASE

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 TYR A 138
PHE A 157
LEU A 206
HIS A 312
LEU A 289
 None
 1.29A 2hc4A-5iq0A:
undetectable		 2hc4A-5iq0A:
20.58
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.
5jsy PERIPLASMIC [NIFESE]
HYDROGENASE, SMALL
SUBUNIT

(Desulfovibrio
vulgaris) 		PF01058
(Oxidored_q6)
PF14720
(NiFe_hyd_SSU_C) 		5 LEU A  37
VAL A  36
VAL A  10
LEU A 116
LEU A 174
 None
 1.07A 2hc4A-5jsyA:
undetectable		 2hc4A-5jsyA:
19.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jx3 URACIL-DNA
GLYCOSYLASE

(Vaccinia virus) 		no annotation 5 LEU A 170
VAL A 152
HIS A 151
LEU A  57
HIS A 147
 None
 1.27A 2hc4A-5jx3A:
undetectable		 2hc4A-5jx3A:
22.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jxd TUMOR NECROSIS
FACTOR ALPHA-INDUCED
PROTEIN 8

(Mus musculus) 		PF05527
(DUF758) 		5 LEU A  51
VAL A  50
SER A  47
LEU A 132
LEU A 171
 6OU  A 201 (-4.4A)
None
6OU  A 201 (-3.5A)
None
6OU  A 201 (-4.9A)
 1.29A 2hc4A-5jxdA:
undetectable		 2hc4A-5jxdA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kju SHIKIMATE
O-HYDROXYCINNAMOYLTR
ANSFERASE

(Arabidopsis
thaliana) 		PF02458
(Transferase) 		5 LEU A 418
VAL A 414
LEU A 257
HIS A 260
LEU A 430
 None
 1.36A 2hc4A-5kjuA:
undetectable		 2hc4A-5kjuA:
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.
5m41 NIGRITOXINE

(Vibrio
nigripulchritudo) 		no annotation 5 LEU A 103
VAL A 206
VAL A 182
LEU A  32
LEU A 199
 None
 1.17A 2hc4A-5m41A:
undetectable		 2hc4A-5m41A:
12.46
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.
5mdx PHOTOSYSTEM II CP43
REACTION CENTER
PROTEIN

(Arabidopsis
thaliana) 		PF00421
(PSII) 		5 TYR C 297
LEU C  95
VAL C 185
VAL C 176
LEU C 202
 CLA  C 503 ( 4.7A)
CLA  C 503 (-4.1A)
None
None
None
 1.30A 2hc4A-5mdxC:
undetectable		 2hc4A-5mdxC:
19.84
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.
5my3 RHO
GTPASE-ACTIVATING
PROTEIN RGD1

(Saccharomyces
cerevisiae) 		no annotation 5 LEU A 110
VAL A 114
SER A  28
VAL A  41
LEU A 161
 None
 1.15A 2hc4A-5my3A:
undetectable		 2hc4A-5my3A:
11.07
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.
5ntf AMINOPEPTIDASE

(Trypanosoma
cruzi) 		PF00883
(Peptidase_M17) 		5 PHE A 508
LEU A 512
SER A 434
VAL A 396
LEU A 334
 None
 1.36A 2hc4A-5ntfA:
undetectable		 2hc4A-5ntfA:
19.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ons MALIGNANT
T-CELL-AMPLIFIED
SEQUENCE 1

(Homo sapiens) 		no annotation 5 PHE A   5
LEU A 174
CYH A  55
LEU A  29
LEU A  92
 None
 1.13A 2hc4A-5onsA:
undetectable		 2hc4A-5onsA:
14.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uso PROTECTION OF
TELOMERES PROTEIN 1

(Schizosaccharomyces
pombe) 		no annotation 5 LEU A  35
VAL A  37
CYH A  79
VAL A  94
LEU A 104
 None
 1.38A 2hc4A-5usoA:
undetectable		 2hc4A-5usoA:
14.94
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.
5v0t ALPHA,ALPHA-TREHALOS
E-PHOSPHATE SYNTHASE
(UDP-FORMING)

(Paraburkholderia
xenovorans) 		PF00982
(Glyco_transf_20) 		5 LEU A 294
SER A 298
VAL A 368
HIS A 367
LEU A 266
 None
None
None
ACT  A 505 ( 4.2A)
EDO  A 503 ( 4.7A)
 1.33A 2hc4A-5v0tA:
undetectable		 2hc4A-5v0tA:
18.98
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.
5v1w GLYCOSIDE HYDROLASE

(Bacillus
halodurans) 		PF03639
(Glyco_hydro_81) 		5 PHE A 773
LEU A 355
VAL A 354
VAL A 724
HIS A 640
 None
None
None
None
PO4  A 806 (-3.8A)
 1.29A 2hc4A-5v1wA:
undetectable		 2hc4A-5v1wA:
17.14
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.
5v76 MICROCOMPARTMENTS
PROTEIN

(Haliangium
ochraceum) 		no annotation 5 LEU A  37
VAL A  36
SER A  35
SER A  24
LEU A  94
 None
 1.05A 2hc4A-5v76A:
undetectable		 2hc4A-5v76A:
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.
5vkt CINNAMYL ALCOHOL
DEHYDROGENASES
(SBCAD4)

(Sorghum bicolor) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 TYR A  95
LEU A 194
CYH A  47
HIS A 258
LEU A 263
 FMT  A 404 (-3.4A)
NAP  A 405 (-3.6A)
ZN  A 401 (-2.3A)
None
None
 1.31A 2hc4A-5vktA:
undetectable		 2hc4A-5vktA:
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.
5z0c NEROL DEHYDROGENASE

(Persicaria
minor) 		no annotation 5 LEU A 196
SER A  53
CYH A  51
HIS A 260
LEU A 265
 BME  A 405 (-3.9A)
ZN  A 402 ( 3.9A)
ZN  A 402 (-2.3A)
None
None
 1.07A 2hc4A-5z0cA:
undetectable		 2hc4A-5z0cA:
15.02
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.
5z0c NEROL DEHYDROGENASE

(Persicaria
minor) 		no annotation 5 VAL A 278
SER A  53
CYH A  51
HIS A 260
LEU A 265
 None
ZN  A 402 ( 3.9A)
ZN  A 402 (-2.3A)
None
None
 1.26A 2hc4A-5z0cA:
undetectable		 2hc4A-5z0cA:
15.02
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.
6ao1 BETA-LACTAMASE
DOMAIN PROTEIN

(Paraburkholderia
phymatum) 		PF00753
(Lactamase_B) 		5 LEU A 248
SER A 252
HIS A 332
HIS A 287
LEU A 291
 None
 1.38A 2hc4A-6ao1A:
undetectable		 2hc4A-6ao1A:
20.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6emg G0S4M2

(Chaetomium
thermophilum) 		no annotation 5 LEU A 232
VAL A 229
SER A 245
LEU A 120
LEU A 159
 None
 1.37A 2hc4A-6emgA:
undetectable		 2hc4A-6emgA:
15.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6fob VITAMIN D3 RECEPTOR
A

(Danio rerio) 		no annotation 6 PHE A 182
LEU A 261
SER A 265
SER A 306
CYH A 316
LEU A 419
 None
DZW  A 501 ( 4.5A)
DZW  A 501 (-3.0A)
DZW  A 501 (-2.7A)
DZW  A 501 (-3.4A)
None
 1.33A 2hc4A-6fobA:
41.3		 2hc4A-6fobA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6fob VITAMIN D3 RECEPTOR
A

(Danio rerio) 		no annotation 8 PHE A 185
LEU A 261
VAL A 262
SER A 265
VAL A 328
HIS A 333
LEU A 337
HIS A 423
 None
DZW  A 501 ( 4.5A)
None
DZW  A 501 (-3.0A)
DZW  A 501 ( 4.3A)
DZW  A 501 (-3.9A)
None
DZW  A 501 (-4.0A)
 1.32A 2hc4A-6fobA:
41.3		 2hc4A-6fobA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6fob VITAMIN D3 RECEPTOR
A

(Danio rerio) 		no annotation 6 TYR A 175
PHE A 182
LEU A 261
VAL A 262
LEU A 338
HIS A 333
 None
None
DZW  A 501 ( 4.5A)
None
None
DZW  A 501 (-3.9A)
 1.43A 2hc4A-6fobA:
41.3		 2hc4A-6fobA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6fob VITAMIN D3 RECEPTOR
A

(Danio rerio) 		no annotation 6 TYR A 175
PHE A 182
LEU A 261
VAL A 262
SER A 265
LEU A 338
 None
None
DZW  A 501 ( 4.5A)
None
DZW  A 501 (-3.0A)
None
 1.12A 2hc4A-6fobA:
41.3		 2hc4A-6fobA:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6fob VITAMIN D3 RECEPTOR
A

(Danio rerio) 		no annotation 12 TYR A 175
PHE A 182
LEU A 261
VAL A 262
SER A 265
SER A 306
CYH A 316
VAL A 328
HIS A 333
LEU A 337
HIS A 423
LEU A 430
 None
None
DZW  A 501 ( 4.5A)
None
DZW  A 501 (-3.0A)
DZW  A 501 (-2.7A)
DZW  A 501 (-3.4A)
DZW  A 501 ( 4.3A)
DZW  A 501 (-3.9A)
None
DZW  A 501 (-4.0A)
None
 0.20A 2hc4A-6fobA:
41.3		 2hc4A-6fobA:
100.00