SIMILAR PATTERNS OF AMINO ACIDS FOR 3WIP_C_ACHC301_0

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 TYR A 420
THR A 429
TYR A 112
TYR A 115
 None
 1.14A 3wipC-1b2hA:
undetectable
3wipD-1b2hA:
undetectable		 3wipC-1b2hA:
16.28
3wipD-1b2hA:
16.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hxm GAMMA-DELTA T-CELL
RECEPTOR

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 THR B  83
TYR B  95
TRP B  37
ARG B  20
 None
 1.30A 3wipC-1hxmB:
0.8
3wipD-1hxmB:
0.8		 3wipC-1hxmB:
23.51
3wipD-1hxmB:
23.51
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.
1i9z PHOSPHATIDYLINOSITOL
PHOSPHATE
PHOSPHATASE

(Schizosaccharomyces
pombe) 		PF03372
(Exo_endo_phos) 		4 TYR A 836
THR A 574
TYR A 565
TRP A 617
 None
 1.47A 3wipC-1i9zA:
undetectable
3wipD-1i9zA:
undetectable		 3wipC-1i9zA:
20.73
3wipD-1i9zA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1m1c MAJOR COAT PROTEIN

(Saccharomyces
cerevisiae
virus L-A) 		PF09220
(LA-virus_coat) 		4 TYR A 485
TRP A 510
THR A 546
ARG A 517
 None
 1.13A 3wipC-1m1cA:
undetectable
3wipD-1m1cA:
undetectable		 3wipC-1m1cA:
15.97
3wipD-1m1cA:
15.97
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.
1oh2 SUCROSE SPECIFIC
PORIN

(Salmonella
enterica) 		PF02264
(LamB) 		4 THR Q 481
TYR Q 118
TYR Q  78
ARG Q 437
 None
 1.34A 3wipC-1oh2Q:
0.0
3wipD-1oh2Q:
undetectable		 3wipC-1oh2Q:
19.74
3wipD-1oh2Q:
19.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1opk PROTO-ONCOGENE
TYROSINE-PROTEIN
KINASE ABL1

(Mus musculus) 		PF00017
(SH2)
PF00018
(SH3_1)
PF07714
(Pkinase_Tyr) 		4 TYR A 475
TRP A 495
ARG A 479
MET A 491
 None
 1.36A 3wipC-1opkA:
undetectable
3wipD-1opkA:
undetectable		 3wipC-1opkA:
18.35
3wipD-1opkA:
18.35
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.
1q7s BIT1

(Homo sapiens) 		PF01981
(PTH2) 		4 THR A 139
TYR A  94
TRP A 108
MET A  67
 None
 1.44A 3wipC-1q7sA:
undetectable
3wipD-1q7sA:
undetectable		 3wipC-1q7sA:
19.83
3wipD-1q7sA:
19.83
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.
1s7s H-2 CLASS I
HISTOCOMPATIBILITY
ANTIGEN, K-B ALPHA
CHAIN

(Mus musculus) 		PF00129
(MHC_I)
PF07654
(C1-set) 		4 TYR A 123
THR A  80
TYR A  85
ARG A  79
 None
 1.49A 3wipC-1s7sA:
undetectable
3wipD-1s7sA:
undetectable		 3wipC-1s7sA:
20.06
3wipD-1s7sA:
20.06
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.
2a3l AMP DEAMINASE

(Arabidopsis
thaliana) 		PF00962
(A_deaminase) 		4 TYR A 261
THR A 326
TYR A 636
TYR A 633
 None
 1.50A 3wipC-2a3lA:
undetectable
3wipD-2a3lA:
undetectable		 3wipC-2a3lA:
14.63
3wipD-2a3lA:
14.63
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2bj0 ACETYLCHOLINE-BINDIN
G PROTEIN

(Bulinus
truncatus) 		PF02931
(Neur_chan_LBD) 		5 TYR A  88
TRP A 142
THR A 143
TYR A 184
TYR A 191
 None
CXS  A1204 (-3.6A)
CXS  A1204 ( 4.7A)
CXS  A1204 (-4.6A)
CXS  A1204 (-4.7A)
 0.69A 3wipC-2bj0A:
25.2
3wipD-2bj0A:
25.2		 3wipC-2bj0A:
40.44
3wipD-2bj0A:
40.44
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.
2cra HOMEOBOX PROTEIN
HOX-B13

(Homo sapiens) 		PF00046
(Homeobox) 		4 THR A  52
TYR A  26
TRP A  54
ARG A  37
 None
 1.05A 3wipC-2craA:
undetectable
3wipD-2craA:
undetectable		 3wipC-2craA:
14.91
3wipD-2craA:
14.91
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.
2cxe RIBULOSE
BISPHOSPHATE
CARBOXYLASE

(Pyrococcus
horikoshii) 		PF00016
(RuBisCO_large)
PF02788
(RuBisCO_large_N) 		4 TYR A 170
THR A 157
TYR A 223
TRP A 178
 None
 1.22A 3wipC-2cxeA:
undetectable
3wipD-2cxeA:
undetectable		 3wipC-2cxeA:
18.29
3wipD-2cxeA:
18.29
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.
2hck HEMATOPOETIC CELL
KINASE HCK

(Homo sapiens) 		PF00017
(SH2)
PF00018
(SH3_1)
PF07714
(Pkinase_Tyr) 		4 TYR A 479
TRP A 499
ARG A 483
MET A 495
 None
 1.36A 3wipC-2hckA:
undetectable
3wipD-2hckA:
undetectable		 3wipC-2hckA:
20.18
3wipD-2hckA:
20.18
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.
2hk5 TYROSINE-PROTEIN
KINASE HCK

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 TYR A 441
TRP A 477
TYR A 457
MET A 474
 None
 1.22A 3wipC-2hk5A:
undetectable
3wipD-2hk5A:
undetectable		 3wipC-2hk5A:
22.85
3wipD-2hk5A:
22.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hk5 TYROSINE-PROTEIN
KINASE HCK

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 TYR A 457
TRP A 477
ARG A 461
MET A 473
 None
 1.37A 3wipC-2hk5A:
undetectable
3wipD-2hk5A:
undetectable		 3wipC-2hk5A:
22.85
3wipD-2hk5A:
22.85
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2inc TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT
TOLUENE, O-XYLENE
MONOOXYGENASE
OXYGENASE SUBUNIT

(Pseudomonas
stutzeri;
Pseudomonas
stutzeri) 		PF02332
(Phenol_Hydrox)
PF04945
(YHS)
PF02332
(Phenol_Hydrox) 		4 TYR B  37
TRP B  46
THR A 182
ARG A 183
 None
 1.32A 3wipC-2incB:
undetectable
3wipD-2incB:
undetectable		 3wipC-2incB:
19.65
3wipD-2incB:
19.65
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o7t TRANSCRIPTIONAL
REGULATOR

(Corynebacterium
glutamicum) 		PF00440
(TetR_N) 		4 TYR A 149
TRP A  85
THR A  86
TYR A 179
 None
 1.35A 3wipC-2o7tA:
undetectable
3wipD-2o7tA:
undetectable		 3wipC-2o7tA:
22.58
3wipD-2o7tA:
22.58
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.
2p1y BISPECIFIC
ALPHA/BETA TCR

(Mus musculus) 		PF07686
(V-set) 		4 TYR A  65
THR A  20
TYR A  90
TRP A  34
 None
 1.25A 3wipC-2p1yA:
undetectable
3wipD-2p1yA:
undetectable		 3wipC-2p1yA:
21.46
3wipD-2p1yA:
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.
2vpt LIPOLYTIC ENZYME

(Ruminiclostridium
thermocellum) 		PF13472
(Lipase_GDSL_2) 		4 TYR A 159
THR A  46
TYR A 214
ARG A  58
 None
 1.46A 3wipC-2vptA:
undetectable
3wipD-2vptA:
undetectable		 3wipC-2vptA:
21.40
3wipD-2vptA:
21.40
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.
2w2r MATRIX PROTEIN

(Vesicular
stomatitis
virus) 		PF06326
(Vesiculo_matrix) 		4 TYR A 105
TYR A  95
TRP A  91
ARG A 159
 None
 1.33A 3wipC-2w2rA:
undetectable
3wipD-2w2rA:
undetectable		 3wipC-2w2rA:
21.97
3wipD-2w2rA:
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.
2wqs AGGLUTININ RECEPTOR

(Streptococcus
gordonii) 		PF16364
(Antigen_C) 		4 TYR A1230
THR A1218
TYR A1105
ARG A1142
 None
 1.32A 3wipC-2wqsA:
undetectable
3wipD-2wqsA:
undetectable		 3wipC-2wqsA:
20.75
3wipD-2wqsA:
20.75
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.
2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III

(Thermus
thermophilus) 		PF00115
(COX1)
PF00510
(COX3) 		4 TYR A 380
THR A 451
TYR A 449
TRP A 459
 HAS  A1015 (-4.9A)
None
None
None
 1.44A 3wipC-2yevA:
undetectable
3wipD-2yevA:
undetectable		 3wipC-2yevA:
13.22
3wipD-2yevA:
13.22
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.
2yev CYTOCHROME C OXIDASE
POLYPEPTIDE I+III
CYTOCHROME C OXIDASE
SUBUNIT 2

(Thermus
thermophilus;
Thermus
thermophilus) 		PF00115
(COX1)
PF00510
(COX3)
PF00034
(Cytochrom_C)
PF00116
(COX2)
PF02790
(COX2_TM) 		4 TYR A 442
THR A 363
TYR B  43
MET A 369
 4AG  A1200 (-3.5A)
None
None
HAS  A1016 ( 4.8A)
 1.45A 3wipC-2yevA:
undetectable
3wipD-2yevA:
undetectable		 3wipC-2yevA:
13.22
3wipD-2yevA:
13.22
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.
2zv7 TYROSINE-PROTEIN
KINASE LYN

(Mus musculus) 		PF07714
(Pkinase_Tyr) 		4 TYR A 460
TRP A 480
ARG A 464
MET A 476
 None
 1.48A 3wipC-2zv7A:
undetectable
3wipD-2zv7A:
undetectable		 3wipC-2zv7A:
20.56
3wipD-2zv7A:
20.56
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.
3bh1 UPF0371 PROTEIN
DIP2346

(Corynebacterium
diphtheriae) 		PF08903
(DUF1846) 		4 TYR A 166
THR A 170
TYR A  32
ARG A 171
 None
 1.47A 3wipC-3bh1A:
undetectable
3wipD-3bh1A:
undetectable		 3wipC-3bh1A:
18.09
3wipD-3bh1A:
18.09
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.
3c6l TCR 2W20 BETA CHAIN

(Mus musculus) 		PF07654
(C1-set)
PF07686
(V-set) 		4 TYR B  62
THR B  18
TYR B  87
TRP B  32
 None
 1.20A 3wipC-3c6lB:
undetectable
3wipD-3c6lB:
undetectable		 3wipC-3c6lB:
22.39
3wipD-3c6lB:
22.39
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.
3j31 COAT PROTEIN

(Sulfolobus
turreted
icosahedral
virus 1) 		no annotation 4 TYR A  59
THR A  91
TYR A 267
TYR A  88
 None
 1.49A 3wipC-3j31A:
undetectable
3wipD-3j31A:
undetectable		 3wipC-3j31A:
19.51
3wipD-3j31A:
19.51
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.
3q62 3-HYDROXYDECANOYL-[A
CYL-CARRIER-PROTEIN]
DEHYDRATASE

(Yersinia pestis) 		PF07977
(FabA) 		4 THR A 126
TYR A 156
ARG A 128
MET A  87
 None
 1.47A 3wipC-3q62A:
undetectable
3wipD-3q62A:
undetectable		 3wipC-3q62A:
18.42
3wipD-3q62A:
18.42
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.
3qdm DMF4 BETA CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 TYR E  64
THR E  20
TYR E  89
TRP E  34
 None
 1.26A 3wipC-3qdmE:
undetectable
3wipD-3qdmE:
undetectable		 3wipC-3qdmE:
21.51
3wipD-3qdmE:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rkx BIOTIN-[ACETYL-COA-C
ARBOXYLASE] LIGASE

(Staphylococcus
aureus) 		PF03099
(BPL_LplA_LipB)
PF08279
(HTH_11) 		4 TYR A 242
TRP A  67
TYR A  75
MET A 137
 None
 1.12A 3wipC-3rkxA:
undetectable
3wipD-3rkxA:
undetectable		 3wipC-3rkxA:
20.54
3wipD-3rkxA:
20.54
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.
3v8d CHOLESTEROL
7-ALPHA-MONOOXYGENAS
E

(Homo sapiens) 		PF00067
(p450) 		4 TYR A 401
THR A 422
TYR A 412
TYR A 433
 None
 1.38A 3wipC-3v8dA:
undetectable
3wipD-3v8dA:
undetectable		 3wipC-3v8dA:
17.98
3wipD-3v8dA:
17.98
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3zdh ACETYLCHOLINE
BINDING PROTEIN

(Lymnaea
stagnalis) 		PF02931
(Neur_chan_LBD) 		5 TYR A  89
TRP A 143
THR A 144
TYR A 185
TYR A 192
 None
XRS  A 301 (-3.6A)
XRS  A 301 ( 4.4A)
XRS  A 301 ( 4.1A)
XRS  A 301 (-3.8A)
 0.44A 3wipC-3zdhA:
32.4
3wipD-3zdhA:
32.4		 3wipC-3zdhA:
100.00
3wipD-3zdhA:
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.
4aqt LAMININ SUBUNIT
GAMMA-1

(Mus musculus) 		PF00053
(Laminin_EGF)
PF00055
(Laminin_N) 		4 TYR A 161
TYR A 175
TYR A 184
ARG A 253
 NAG  A3001 ( 4.1A)
None
None
None
 1.28A 3wipC-4aqtA:
undetectable
3wipD-4aqtA:
undetectable		 3wipC-4aqtA:
20.00
3wipD-4aqtA:
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.
4bxs VENOM PROTHROMBIN
ACTIVATOR
PSEUTARIN-C
NON-CATALYTIC
SUBUNIT

(Pseudonaja
textilis) 		PF00754
(F5_F8_type_C)
PF07732
(Cu-oxidase_3) 		4 TYR V 941
TYR V 798
TRP V 921
ARG V 796
 None
 1.49A 3wipC-4bxsV:
undetectable
3wipD-4bxsV:
undetectable		 3wipC-4bxsV:
10.98
3wipD-4bxsV:
10.98
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.
4d1d HYDANTOIN TRANSPORT
PROTEIN

(Microbacterium
liquefaciens) 		PF02133
(Transp_cyt_pur) 		4 TYR A 395
THR A  20
TYR A 465
ARG A  25
 None
 1.42A 3wipC-4d1dA:
undetectable
3wipD-4d1dA:
undetectable		 3wipC-4d1dA:
18.09
3wipD-4d1dA:
18.09
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4hqp ALPHA7 NICOTINIC
RECEPTOR CHIMERA

(Lymnaea
stagnalis;
Homo sapiens) 		PF02931
(Neur_chan_LBD) 		4 TYR A  91
TRP A 145
THR A 146
TYR A 191
 None
 0.58A 3wipC-4hqpA:
26.8
3wipD-4hqpA:
26.9		 3wipC-4hqpA:
57.52
3wipD-4hqpA:
57.52
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.
4juo DNA TOPOISOMERASE 4
SUBUNIT B

(Streptococcus
pneumoniae) 		PF00204
(DNA_gyraseB)
PF00986
(DNA_gyraseB_C)
PF01751
(Toprim)
PF02518
(HATPase_c) 		4 TYR C 580
THR C 595
TYR C 557
TRP C 559
 None
 1.40A 3wipC-4juoC:
undetectable
3wipD-4juoC:
undetectable		 3wipC-4juoC:
15.19
3wipD-4juoC:
15.19
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.
4jy4 PGT121 LIGHT CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 THR A  74
TYR A  86
TRP A  35
ARG A  20
 None
 1.44A 3wipC-4jy4A:
3.1
3wipD-4jy4A:
3.1		 3wipC-4jy4A:
23.43
3wipD-4jy4A:
23.43
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.
4mwt LYSOSOMAL PROTECTIVE
PROTEIN

(Homo sapiens) 		PF00450
(Peptidase_S10) 		4 TYR A 155
TYR A 151
ARG A 347
MET A 349
 TYR  A 155 ( 1.3A)
TYR  A 151 ( 1.3A)
ARG  A 347 ( 0.6A)
MET  A 349 ( 0.0A)
 1.49A 3wipC-4mwtA:
undetectable
3wipD-4mwtA:
undetectable		 3wipC-4mwtA:
18.71
3wipD-4mwtA:
18.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oli NON-RECEPTOR
TYROSINE-PROTEIN
KINASE TYK2

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		4 TYR A1013
THR A 953
TYR A 955
ARG A 952
 None
 1.20A 3wipC-4oliA:
undetectable
3wipD-4oliA:
undetectable		 3wipC-4oliA:
16.43
3wipD-4oliA:
16.43
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.
4tmc OLD YELLOW ENZYME

(Kluyveromyces
marxianus) 		PF00724
(Oxidored_FMN) 		4 TYR A 142
THR A 138
TYR A 134
ARG A 209
 None
 1.48A 3wipC-4tmcA:
undetectable
3wipD-4tmcA:
undetectable		 3wipC-4tmcA:
21.29
3wipD-4tmcA:
21.29
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.
4ueu TYROSINE KINASE AS -
A COMMON ANCESTOR OF
SRC AND ABL

(synthetic
construct) 		PF07714
(Pkinase_Tyr) 		4 TYR A 222
TRP A 242
ARG A 226
MET A 238
 None
 1.32A 3wipC-4ueuA:
undetectable
3wipD-4ueuA:
undetectable		 3wipC-4ueuA:
21.40
3wipD-4ueuA:
21.40
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.
4wr3 ALANINE RACEMASE,
BIOSYNTHETIC

(Escherichia
coli) 		PF00842
(Ala_racemase_C)
PF01168
(Ala_racemase_N) 		4 TRP A 120
THR A 118
TRP A 207
ARG A 151
 None
 1.42A 3wipC-4wr3A:
undetectable
3wipD-4wr3A:
undetectable		 3wipC-4wr3A:
20.49
3wipD-4wr3A:
20.49
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zem TRANSLATION
INITIATION FACTOR
EIF2B-LIKE
PROTEIN,TRANSLATION
INITIATION FACTOR
EIF2B-LIKE PROTEIN

(Chaetomium
thermophilum) 		PF01008
(IF-2B) 		4 TYR A 220
THR A 276
TYR A 287
ARG A 266
 None
 1.21A 3wipC-4zemA:
undetectable
3wipD-4zemA:
undetectable		 3wipC-4zemA:
20.79
3wipD-4zemA:
20.79
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zgv FERREDOXIN RECEPTOR

(Pectobacterium
atrosepticum) 		PF07715
(Plug) 		4 TYR A 362
THR A 416
TYR A 341
TYR A 364
 None
None
BOG  A 903 (-4.1A)
None
 1.26A 3wipC-4zgvA:
undetectable
3wipD-4zgvA:
undetectable		 3wipC-4zgvA:
14.07
3wipD-4zgvA:
14.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5esa ANTI-HCV E2
GLYCOPROTEIN FAB
LIGHT CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 THR B  73
TYR B  85
TRP B  34
ARG B  19
 None
 1.26A 3wipC-5esaB:
undetectable
3wipD-5esaB:
2.6		 3wipC-5esaB:
23.95
3wipD-5esaB:
23.95
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.
5euo PF6 TCR BETA CHAIN

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 TYR F  62
THR F  18
TYR F  87
TRP F  32
 None
 1.24A 3wipC-5euoF:
undetectable
3wipD-5euoF:
undetectable		 3wipC-5euoF:
21.76
3wipD-5euoF:
21.76
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.
5fjv NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-2

(Homo sapiens) 		PF02931
(Neur_chan_LBD) 		5 TYR A 122
TRP A 178
THR A 179
TYR A 219
TYR A 226
 EPJ  A 300 (-4.6A)
EPJ  A 300 (-3.7A)
EPJ  A 300 (-3.3A)
EPJ  A 300 (-3.7A)
EPJ  A 300 (-3.7A)
 0.66A 3wipC-5fjvA:
22.9
3wipD-5fjvA:
22.9		 3wipC-5fjvA:
27.35
3wipD-5fjvA:
27.35
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.
5hyp C4B-BINDING PROTEIN
ALPHA CHAIN

(Homo sapiens) 		PF00084
(Sushi) 		4 TYR A  56
THR A   7
TYR A  31
TRP A  54
 None
 1.49A 3wipC-5hypA:
undetectable
3wipD-5hypA:
undetectable		 3wipC-5hypA:
19.23
3wipD-5hypA:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jph ACETYLTRANSFERASE
SACOL1063

(Staphylococcus
aureus) 		PF13673
(Acetyltransf_10) 		4 TYR A  47
THR A  55
ARG A  18
MET A  74
 None
CL  A 203 (-3.8A)
CL  A 203 (-4.0A)
None
 1.32A 3wipC-5jphA:
undetectable
3wipD-5jphA:
undetectable		 3wipC-5jphA:
19.56
3wipD-5jphA:
19.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5kxi NEURONAL
ACETYLCHOLINE
RECEPTOR SUBUNIT
ALPHA-4

(Homo sapiens) 		PF02931
(Neur_chan_LBD)
PF02932
(Neur_chan_memb) 		5 TYR A 100
TRP A 156
THR A 157
TYR A 197
TYR A 204
 NCT  A 402 (-4.8A)
NCT  A 402 (-3.9A)
NCT  A 402 (-4.6A)
NCT  A 402 ( 4.9A)
NCT  A 402 (-3.8A)
 0.74A 3wipC-5kxiA:
23.3
3wipD-5kxiA:
23.5		 3wipC-5kxiA:
20.93
3wipD-5kxiA:
20.93
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.
5n2d PROGRAMMED CELL
DEATH 1 LIGAND 1

(Homo sapiens) 		PF07686
(V-set) 		4 TYR A 112
THR A  37
TYR A  28
TRP A  57
 None
 1.33A 3wipC-5n2dA:
undetectable
3wipD-5n2dA:
undetectable		 3wipC-5n2dA:
18.70
3wipD-5n2dA:
18.70
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5nx2 GLUCAGON-LIKE
PEPTIDE 1 RECEPTOR

(Homo sapiens) 		PF00002
(7tm_2)
PF02793
(HRM) 		4 TYR A  88
TRP A 214
TYR A  69
ARG A 215
 None
 1.29A 3wipC-5nx2A:
undetectable
3wipD-5nx2A:
undetectable		 3wipC-5nx2A:
19.46
3wipD-5nx2A:
19.46
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.
5ofb MORC FAMILY CW-TYPE
ZINC FINGER PROTEIN
2

(Homo sapiens) 		no annotation 4 TYR B 450
TYR B 272
TRP B 451
ARG B 459
 None
 1.47A 3wipC-5ofbB:
undetectable
3wipD-5ofbB:
undetectable		 3wipC-5ofbB:
undetectable
3wipD-5ofbB:
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.
5uz7 CALCITONIN RECEPTOR

(Homo sapiens) 		PF00002
(7tm_2) 		4 TYR R 262
TYR R 243
TRP R 236
ARG R 180
 None
 1.07A 3wipC-5uz7R:
undetectable
3wipD-5uz7R:
undetectable		 3wipC-5uz7R:
17.37
3wipD-5uz7R:
17.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xj4 PROGRAMMED CELL
DEATH 1 LIGAND 1

(Homo sapiens) 		no annotation 4 TYR A 112
THR A  37
TYR A  28
TRP A  57
 None
 1.26A 3wipC-5xj4A:
undetectable
3wipD-5xj4A:
undetectable		 3wipC-5xj4A:
undetectable
3wipD-5xj4A:
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.
5xwd VL CHAIN OF 059-152

(Homo sapiens) 		no annotation 4 THR D  74
TYR D  86
TRP D  35
ARG D  20
 None
 1.19A 3wipC-5xwdD:
undetectable
3wipD-5xwdD:
undetectable		 3wipC-5xwdD:
undetectable
3wipD-5xwdD:
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.
5y0q UPF0348 PROTEIN
B4417_3650

(Bacillus
subtilis) 		no annotation 4 THR A 246
TYR A 237
TRP A 244
MET A 214
 None
 1.44A 3wipC-5y0qA:
undetectable
3wipD-5y0qA:
undetectable		 3wipC-5y0qA:
undetectable
3wipD-5y0qA:
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.
5z06 BDI_3064 PROTEIN

(Parabacteroides
distasonis) 		no annotation 4 TYR A 530
THR A 483
TYR A 573
TRP A 480
 None
 1.20A 3wipC-5z06A:
undetectable
3wipD-5z06A:
undetectable		 3wipC-5z06A:
undetectable
3wipD-5z06A:
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.
5zzn


(;
) 		no annotation
no annotation 		4 THR V  63
TYR U  42
TYR V  82
ARG U  39
 None
None
HEM  V 201 (-4.6A)
None
 1.24A 3wipC-5zznV:
undetectable
3wipD-5zznV:
undetectable		 3wipC-5zznV:
undetectable
3wipD-5zznV:
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.
6amu -

(-) 		no annotation 4 TYR E  67
THR E  23
TYR E  92
TRP E  37
 None
 1.28A 3wipC-6amuE:
undetectable
3wipD-6amuE:
undetectable		 3wipC-6amuE:
undetectable
3wipD-6amuE:
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.
6dd3 CYTOSOLIC PURINE
5'-NUCLEOTIDASE

(Homo sapiens) 		no annotation 4 THR A 155
TYR A  60
TYR A  55
ARG A  98
 None
 1.39A 3wipC-6dd3A:
undetectable
3wipD-6dd3A:
undetectable		 3wipC-6dd3A:
undetectable
3wipD-6dd3A:
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.
6dd3 CYTOSOLIC PURINE
5'-NUCLEOTIDASE

(Homo sapiens) 		no annotation 4 THR A 155
TYR A  65
TYR A  55
ARG A  98
 None
 1.27A 3wipC-6dd3A:
undetectable
3wipD-6dd3A:
undetectable		 3wipC-6dd3A:
undetectable
3wipD-6dd3A:
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.
6fm9 UDP-N-ACETYLGLUCOSAM
INE--DOLICHYL-PHOSPH
ATE
N-ACETYLGLUCOSAMINEP
HOSPHOTRANSFERASE

(Homo sapiens) 		no annotation 4 THR A 362
TYR A 288
ARG A 303
MET A 316
 None
 1.41A 3wipC-6fm9A:
undetectable
3wipD-6fm9A:
undetectable		 3wipC-6fm9A:
undetectable
3wipD-6fm9A:
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.
8fab IGG1-LAMBDA HIL FAB
(LIGHT CHAIN)

(Homo sapiens) 		PF07654
(C1-set)
PF07686
(V-set) 		4 THR A  73
TYR A  85
TRP A  34
ARG A  19
 None
 1.17A 3wipC-8fabA:
3.0
3wipD-8fabA:
3.1		 3wipC-8fabA:
23.38
3wipD-8fabA:
23.38