SIMILAR PATTERNS OF AMINO ACIDS FOR 3GWW_A_SFXA801_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.
1a8s CHLOROPEROXIDASE F

(Pseudomonas
fluorescens) 		PF00561
(Abhydrolase_1) 		5 GLY A 116
LEU A 117
ILE A 212
PHE A 270
ALA A 237
 None
 1.07A 3gwwA-1a8sA:
0.0		 3gwwA-1a8sA:
19.55
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.
1cj2 PROTEIN
(P-HYDROXYBENZOATE
HYDROXYLASE)

(Pseudomonas
fluorescens) 		PF01494
(FAD_binding_3) 		5 LEU A 281
GLY A 279
LEU A 132
ILE A 155
ASP A 151
 None
 1.10A 3gwwA-1cj2A:
0.0		 3gwwA-1cj2A:
21.15
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.
1e0c SULFURTRANSFERASE

(Azotobacter
vinelandii) 		PF00581
(Rhodanese) 		5 LEU A 158
GLY A 156
LEU A 154
ARG A 157
ASP A 162
 EDO  A 374 (-4.3A)
None
None
None
None
 1.09A 3gwwA-1e0cA:
undetectable		 3gwwA-1e0cA:
21.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1exb KV BETA2 PROTEIN

(Rattus
norvegicus) 		PF00248
(Aldo_ket_red) 		5 LEU A  52
GLY A  53
LEU A 322
ILE A 334
ALA A 324
 None
None
None
None
NDP  A1000 ( 4.9A)
 0.94A 3gwwA-1exbA:
0.0		 3gwwA-1exbA:
20.80
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.
1fiw BETA-ACROSIN HEAVY
CHAIN

(Ovis aries) 		PF00089
(Trypsin) 		5 LEU A  53
LEU A  47
GLN A  50
ILE A 238
ALA A 246
 None
 1.08A 3gwwA-1fiwA:
undetectable		 3gwwA-1fiwA:
18.16
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.
1ftg APOFLAVODOXIN

(Nostoc sp. PCC
7119) 		PF00258
(Flavodoxin_1) 		5 GLY A 168
LEU A 169
TYR A  49
ILE A   4
PHE A  26
 None
 1.02A 3gwwA-1ftgA:
0.0		 3gwwA-1ftgA:
15.42
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.
1lqa TAS PROTEIN

(Escherichia
coli) 		PF00248
(Aldo_ket_red) 		5 LEU A  16
GLY A  17
LEU A 307
ILE A 319
ALA A 309
 None
 1.01A 3gwwA-1lqaA:
0.0		 3gwwA-1lqaA:
20.68
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.
1m64 FLAVOCYTOCHROME C3

(Shewanella
frigidimarina) 		PF00890
(FAD_binding_2)
PF14537
(Cytochrom_c3_2) 		5 LEU A 461
GLY A 458
LEU A 447
ILE A 420
ALA A 444
 None
 1.10A 3gwwA-1m64A:
undetectable		 3gwwA-1m64A:
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.
1rhc F420-DEPENDENT
ALCOHOL
DEHYDROGENASE

(Methanoculleus
thermophilus) 		PF00296
(Bac_luciferase) 		5 LEU A 250
GLY A 248
GLN A 266
TYR A 281
ILE A 277
 None
 0.96A 3gwwA-1rhcA:
0.0		 3gwwA-1rhcA:
19.77
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.
1sng COG4826: SERINE
PROTEASE INHIBITOR

(Thermobifida
fusca) 		PF00079
(Serpin) 		5 LEU A   8
GLY A 350
ARG A   9
ALA A  40
ASP A  11
 None
None
None
CAF  A  41 ( 3.1A)
None
 1.09A 3gwwA-1sngA:
0.0		 3gwwA-1sngA:
21.26
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.
1tqh CARBOXYLESTERASE
PRECURSOR

(Geobacillus
stearothermophilus) 		PF12146
(Hydrolase_4) 		5 LEU A  35
GLY A  36
LEU A  39
PHE A  10
ALA A  18
 None
 1.05A 3gwwA-1tqhA:
undetectable		 3gwwA-1tqhA:
18.83
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.
1v3t LEUKOTRIENE B4
12-HYDROXYDEHYDROGEN
ASE/PROSTAGLANDIN
15-KETO REDUCTASE

(Cavia porcellus) 		PF00107
(ADH_zinc_N)
PF16884
(ADH_N_2) 		5 LEU A 133
GLY A 132
LEU A 134
ILE A 161
ALA A 283
 None
 0.94A 3gwwA-1v3tA:
undetectable		 3gwwA-1v3tA:
20.85
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.
1xvx YFUA

(Yersinia
enterocolitica) 		PF13343
(SBP_bac_6) 		5 LEU A 284
LEU A 287
GLN A 222
TYR A  91
ALA A 226
 None
 1.02A 3gwwA-1xvxA:
undetectable		 3gwwA-1xvxA:
20.04
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xvy SFUA

(Yersinia
enterocolitica) 		PF13343
(SBP_bac_6) 		5 LEU A 281
LEU A 284
GLN A 219
TYR A  88
ALA A 223
 None
 1.09A 3gwwA-1xvyA:
undetectable		 3gwwA-1xvyA:
21.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z6t APOPTOTIC PROTEASE
ACTIVATING FACTOR 1

(Homo sapiens) 		PF00619
(CARD)
PF00931
(NB-ARC) 		5 GLY A 159
LEU A 163
ILE A 152
ALA A 165
ASP A 243
 ADP  A 900 (-3.2A)
None
None
None
ADP  A 900 ( 4.7A)
 1.00A 3gwwA-1z6tA:
undetectable		 3gwwA-1z6tA:
19.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z9c ORGANIC
HYDROPEROXIDE
RESISTANCE
TRANSCRIPTIONAL
REGULATOR

(Bacillus
subtilis) 		PF01047
(MarR) 		5 LEU A  83
GLY A 104
LEU A 107
ILE A  38
ALA A 111
 None
 1.08A 3gwwA-1z9cA:
undetectable		 3gwwA-1z9cA:
14.93
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.
2cyc TYROSYL-TRNA
SYNTHETASE

(Pyrococcus
horikoshii) 		PF00579
(tRNA-synt_1b) 		5 LEU A  48
GLY A  49
LEU A  52
ILE A 296
ALA A  56
 None
 1.09A 3gwwA-2cycA:
undetectable		 3gwwA-2cycA:
23.20
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.
2dwu GLUTAMATE RACEMASE

(Bacillus
anthracis) 		PF01177
(Asp_Glu_race) 		5 LEU A 186
GLY A 187
ILE A 208
ALA A 107
ASP A 182
 None
 1.08A 3gwwA-2dwuA:
undetectable		 3gwwA-2dwuA:
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.
2h4t CARNITINE
O-PALMITOYLTRANSFERA
SE II, MITOCHONDRIAL

(Rattus
norvegicus) 		PF00755
(Carn_acyltransf) 		5 LEU A 325
LEU A 358
ARG A 350
ALA A 367
ASP A 328
 None
 0.88A 3gwwA-2h4tA:
undetectable		 3gwwA-2h4tA:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nsg HYPOTHETICAL PROTEIN
CGL3021

(Corynebacterium
glutamicum) 		PF11716
(MDMPI_N) 		5 GLY A 214
ARG A 217
ILE A 161
ALA A 220
ASP A 151
 None
SO4  A 402 (-3.7A)
None
None
None
 1.03A 3gwwA-2nsgA:
undetectable		 3gwwA-2nsgA:
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.
2p4d DUAL SPECIFICITY
PROTEIN PHOSPHATASE

(Variola virus) 		PF00782
(DSPc) 		5 LEU A 122
GLY A 118
ILE A 162
PHE A  89
ASP A  84
 None
 0.90A 3gwwA-2p4dA:
undetectable		 3gwwA-2p4dA:
14.93
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.
2q7a CELL SURFACE
HEME-BINDING PROTEIN

(Streptococcus
pyogenes) 		PF11545
(HemeBinding_Shp) 		5 LEU A 137
LEU A  87
GLN A 177
ILE A 144
PHE A  89
 None
 1.09A 3gwwA-2q7aA:
undetectable		 3gwwA-2q7aA:
14.76
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.
2vdc GLUTAMATE SYNTHASE
[NADPH] SMALL CHAIN

(Azospirillum
brasilense) 		PF07992
(Pyr_redox_2)
PF14691
(Fer4_20) 		5 LEU G 295
GLY G 296
LEU G 399
ALA G 245
ASP G 263
 None
 1.00A 3gwwA-2vdcG:
undetectable		 3gwwA-2vdcG:
23.09
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.
2whd THIOREDOXIN
REDUCTASE

(Hordeum vulgare) 		PF07992
(Pyr_redox_2) 		5 LEU A 262
GLY A 264
LEU A 266
ALA A 275
ASP A 271
 None
 1.01A 3gwwA-2whdA:
undetectable		 3gwwA-2whdA:
22.35
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.
2y7c GENE 0.3 PROTEIN
TYPE-1 RESTRICTION
ENZYME ECOKI
SPECIFICITY PROTEIN

(Escherichia
coli;
Escherichia
virus T7) 		PF01420
(Methylase_S)
PF08684
(ocr) 		5 GLY A  91
ILE A  49
ALA A 106
PHE A 107
ASP D  63
 None
 1.06A 3gwwA-2y7cA:
undetectable		 3gwwA-2y7cA:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2zc0 ALANINE GLYOXYLATE
TRANSAMINASE

(Thermococcus
litoralis) 		PF00155
(Aminotran_1_2) 		5 LEU A 114
GLY A 115
LEU A 118
ILE A 240
PHE A 139
 None
 1.09A 3gwwA-2zc0A:
undetectable		 3gwwA-2zc0A:
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.
3byq UNCHARACTERIZED
PROTEIN DUF1185

(Bordetella
bronchiseptica) 		PF06684
(AA_synth) 		5 LEU A  59
GLY A  60
LEU A  56
ILE A   4
ALA A  54
 None
 1.04A 3gwwA-3byqA:
undetectable		 3gwwA-3byqA:
16.83
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.
3eza PHOSPHOTRANSFERASE
SYSTEM, ENZYME I

(Escherichia
coli) 		PF00391
(PEP-utilizers)
PF05524
(PEP-utilisers_N) 		5 LEU A 142
GLY A 143
LEU A 144
ILE A  24
ASP A 132
 None
 1.08A 3gwwA-3ezaA:
undetectable		 3gwwA-3ezaA:
21.56
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.
3f1v DNA POLYMERASE III
SUBUNIT BETA

(Escherichia
coli) 		PF00712
(DNA_pol3_beta)
PF02767
(DNA_pol3_beta_2)
PF02768
(DNA_pol3_beta_3) 		5 LEU A 331
LEU A 328
TYR A 359
ILE A 349
PHE A 144
 None
 1.08A 3gwwA-3f1vA:
undetectable		 3gwwA-3f1vA:
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.
3gse MENAQUINONE-SPECIFIC
ISOCHORISMATE
SYNTHASE

(Yersinia pestis) 		PF00425
(Chorismate_bind) 		5 LEU A   8
GLY A   9
LEU A  11
ARG A  12
ASP A 163
 None
 1.01A 3gwwA-3gseA:
undetectable		 3gwwA-3gseA:
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.
3hba PUTATIVE
PHOSPHOSUGAR
ISOMERASE

(Shewanella
denitrificans) 		PF01380
(SIS) 		5 LEU A 299
LEU A 185
ILE A 296
ALA A 187
ASP A 291
 None
 1.06A 3gwwA-3hbaA:
undetectable		 3gwwA-3hbaA:
23.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hvu HYPOXANTHINE
PHOSPHORIBOSYLTRANSF
ERASE

(Bacillus
anthracis) 		PF00156
(Pribosyltran) 		5 LEU A 108
GLY A 105
ARG A 135
ILE A 125
ASP A 130
 MES  A 181 (-3.7A)
MES  A 181 (-3.0A)
None
None
None
 1.04A 3gwwA-3hvuA:
undetectable		 3gwwA-3hvuA:
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.
3ial PROLYL-TRNA
SYNTHETASE

(Giardia
intestinalis) 		PF00587
(tRNA-synt_2b)
PF03129
(HGTP_anticodon)
PF09180
(ProRS-C_1) 		6 GLY A 385
LEU A 383
ARG A 407
ILE A  55
PHE A  39
ASP A 311
 None
 1.21A 3gwwA-3ialA:
undetectable		 3gwwA-3ialA:
22.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3iuv UNCHARACTERIZED TETR
FAMILY PROTEIN

(Streptomyces
coelicolor) 		PF00440
(TetR_N) 		5 LEU A  92
GLY A  93
LEU A  96
ILE A 153
ASP A 165
 None
 1.11A 3gwwA-3iuvA:
undetectable		 3gwwA-3iuvA:
15.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3kmu INTEGRIN-LINKED
KINASE

(Homo sapiens) 		PF07714
(Pkinase_Tyr) 		5 TYR A 274
ILE A 327
PHE A 287
ALA A 294
PHE A 297
 None
 0.99A 3gwwA-3kmuA:
0.4		 3gwwA-3kmuA:
19.57
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.
3ksd GLYCERALDEHYDE-3-PHO
SPHATE DEHYDROGENASE
1

(Staphylococcus
aureus) 		no annotation 5 GLY Q 148
LEU Q 324
ILE Q  13
ALA Q 322
ASP Q 315
 None
None
NAD  Q 337 (-4.4A)
None
None
 1.10A 3gwwA-3ksdQ:
undetectable		 3gwwA-3ksdQ:
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.
3lpm PUTATIVE
METHYLTRANSFERASE

(Listeria
monocytogenes) 		PF05175
(MTS) 		5 LEU A   8
LEU A   6
ILE A  25
ALA A  93
ASP A  86
 None
 1.02A 3gwwA-3lpmA:
undetectable		 3gwwA-3lpmA:
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.
3mop MYELOID
DIFFERENTIATION
PRIMARY RESPONSE
PROTEIN MYD88

(Homo sapiens) 		PF00531
(Death) 		5 LEU A  75
GLY A  72
LEU A  74
GLN A  67
PHE A  56
 None
 1.05A 3gwwA-3mopA:
undetectable		 3gwwA-3mopA:
12.52
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3mpn TRANSPORTER

(Aquifex
aeolicus) 		PF00209
(SNF) 		5 LEU A  25
GLY A  26
LEU A  29
ARG A  30
ALA A 319
 LEU  A 601 (-4.9A)
LEU  A 601 (-3.1A)
None
None
None
 1.08A 3gwwA-3mpnA:
68.0		 3gwwA-3mpnA:
99.80
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3mpn TRANSPORTER

(Aquifex
aeolicus) 		PF00209
(SNF) 		11 LEU A  25
GLY A  26
LEU A  29
GLN A  34
TYR A 108
ILE A 111
PHE A 253
ALA A 319
PHE A 320
ASP A 401
ASP A 404
 LEU  A 601 (-4.9A)
LEU  A 601 (-3.1A)
None
None
LEU  A 601 (-4.5A)
None
LEU  A 601 (-4.2A)
None
None
None
None
 0.53A 3gwwA-3mpnA:
68.0		 3gwwA-3mpnA:
99.80
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.
3nx3 ACETYLORNITHINE
AMINOTRANSFERASE

(Campylobacter
jejuni) 		PF00202
(Aminotran_3) 		5 LEU A 205
LEU A 208
ARG A 206
ILE A 183
ASP A 242
 None
 1.02A 3gwwA-3nx3A:
undetectable		 3gwwA-3nx3A:
21.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3o0y LIPOPROTEIN

(Colwellia
psychrerythraea) 		PF05960
(DUF885) 		5 LEU A 558
GLY A 555
ILE A 305
ALA A 291
ASP A 511
 None
 1.03A 3gwwA-3o0yA:
1.6		 3gwwA-3o0yA:
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.
3r9w GTPASE ERA

(Aquifex
aeolicus) 		PF01926
(MMR_HSR1)
PF07650
(KH_2) 		5 LEU A  19
GLY A  15
ILE A 154
ALA A  95
ASP A 126
 None
GNP  A 402 (-3.2A)
None
None
GNP  A 402 (-3.0A)
 1.09A 3gwwA-3r9wA:
undetectable		 3gwwA-3r9wA:
20.48
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.
3rko NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT J
NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT K

(Escherichia
coli) 		no annotation 5 LEU J  54
GLY J  52
ILE K  66
PHE J  43
ALA J  60
 None
 1.07A 3gwwA-3rkoJ:
2.6		 3gwwA-3rkoJ:
17.54
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.
3rpl D-FRUCTOSE
1,6-BISPHOSPHATASE
CLASS
2/SEDOHEPTULOSE
1,7-BISPHOSPHATASE

(Synechocystis
sp. PCC 6803) 		PF03320
(FBPase_glpX) 		5 LEU A 302
LEU A 318
ILE A 205
ALA A 293
PHE A 292
 None
 0.80A 3gwwA-3rplA:
undetectable		 3gwwA-3rplA:
20.57
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.
3sfz APOPTOTIC PEPTIDASE
ACTIVATING FACTOR 1

(Mus musculus) 		PF00400
(WD40)
PF00931
(NB-ARC)
PF12894
(ANAPC4_WD40) 		5 GLY A 159
LEU A 163
ILE A 152
ALA A 165
ASP A 243
 ADP  A1250 (-3.0A)
None
None
None
None
 1.04A 3gwwA-3sfzA:
undetectable		 3gwwA-3sfzA:
17.74
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.
3tfo PUTATIVE
3-OXOACYL-(ACYL-CARR
IER-PROTEIN)
REDUCTASE

(Sinorhizobium
meliloti) 		PF00106
(adh_short) 		5 LEU A  33
GLY A  34
ILE A  31
ALA A  75
ASP A  83
 None
 0.92A 3gwwA-3tfoA:
undetectable		 3gwwA-3tfoA:
19.77
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.
3wdj TYPE I PULLULANASE

(Anoxybacillus
sp. LM18-11) 		PF00128
(Alpha-amylase)
PF02922
(CBM_48) 		5 GLY A 263
LEU A 264
ILE A 337
PHE A 232
ALA A 328
 None
 1.08A 3gwwA-3wdjA:
undetectable		 3gwwA-3wdjA:
22.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3wsy SORTILIN-RELATED
RECEPTOR

(Homo sapiens) 		PF15901
(Sortilin_C)
PF15902
(Sortilin-Vps10) 		5 LEU A 209
LEU A 219
TYR A 168
ILE A 178
PHE A 237
 None
 0.94A 3gwwA-3wsyA:
undetectable		 3gwwA-3wsyA:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3zk4 DIPHOSPHONUCLEOTIDE
PHOSPHATASE 1

(Lupinus luteus) 		PF00149
(Metallophos)
PF14008
(Metallophos_C)
PF16656
(Pur_ac_phosph_N) 		5 LEU A 464
TYR A 412
ILE A 415
ALA A 473
PHE A 432
 None
 0.84A 3gwwA-3zk4A:
undetectable		 3gwwA-3zk4A:
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.
4aca TRANSLATION
ELONGATION FACTOR
SELB

(Methanococcus
maripaludis) 		PF00009
(GTP_EFTU)
PF03144
(GTP_EFTU_D2) 		5 LEU A  21
GLY A  17
ILE A 154
ALA A  92
ASP A 122
 None
 1.06A 3gwwA-4acaA:
undetectable		 3gwwA-4acaA:
22.56
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.
4b9i CS6 FIMBRIAL SUBUNIT
A, CS6 FIMBRIAL
SUBUNIT B

(Escherichia
coli) 		no annotation 5 LEU A  61
GLY A  60
ILE A  75
ALA A 104
ASP A 121
 None
 1.08A 3gwwA-4b9iA:
undetectable		 3gwwA-4b9iA:
13.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4b9j CS6 FIMBRIAL SUBUNIT
A

(Escherichia
coli) 		no annotation 5 LEU A  61
GLY A  60
ILE A  75
ALA A 104
ASP A 121
 None
 1.10A 3gwwA-4b9jA:
undetectable		 3gwwA-4b9jA:
14.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4d82 AAA ATPASE, CENTRAL
DOMAIN PROTEIN

(Metallosphaera
sedula) 		PF00004
(AAA)
PF09336
(Vps4_C) 		5 GLY A 133
ILE A 199
PHE A 261
ALA A 148
ASP A 202
 None
 1.10A 3gwwA-4d82A:
undetectable		 3gwwA-4d82A:
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.
4db3 N-ACETYL-D-GLUCOSAMI
NE KINASE

(Vibrio
vulnificus) 		PF00480
(ROK) 		5 LEU A 251
GLY A 252
LEU A 130
TYR A 262
ILE A 261
 None
 1.09A 3gwwA-4db3A:
undetectable		 3gwwA-4db3A:
22.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e77 GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE

(Yersinia pestis) 		PF00202
(Aminotran_3) 		5 LEU A 223
LEU A 226
ARG A 224
ILE A 201
ASP A 259
 None
 1.00A 3gwwA-4e77A:
undetectable		 3gwwA-4e77A:
24.56
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.
4f1r CATABOLITE
REPRESSION CONTROL
PROTEIN

(Pseudomonas
aeruginosa) 		PF03372
(Exo_endo_phos) 		5 LEU A  19
GLY A  18
LEU A  20
ILE A  11
PHE A  48
 None
 0.96A 3gwwA-4f1rA:
undetectable		 3gwwA-4f1rA:
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.
4fzw 1,2-EPOXYPHENYLACETY
L-COA ISOMERASE

(Escherichia
coli) 		PF00378
(ECH_1) 		5 GLY C 120
LEU C 119
ILE C 181
ALA C 110
PHE C 132
 None
 0.96A 3gwwA-4fzwC:
undetectable		 3gwwA-4fzwC:
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.
4fzw 1,2-EPOXYPHENYLACETY
L-COA ISOMERASE

(Escherichia
coli) 		PF00378
(ECH_1) 		5 GLY C 121
LEU C 119
ILE C 181
ALA C 110
PHE C 132
 None
 0.97A 3gwwA-4fzwC:
undetectable		 3gwwA-4fzwC:
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.
4i6n UBIQUITIN
CARBOXYL-HYDROLASE

(Trichinella
spiralis) 		PF01088
(Peptidase_C12) 		5 LEU A  36
LEU A 218
ILE A 199
ALA A 220
PHE A  49
 None
 0.82A 3gwwA-4i6nA:
1.1		 3gwwA-4i6nA:
18.08
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.
4iws PA0254

(Pseudomonas
aeruginosa) 		PF01977
(UbiD) 		5 LEU A 209
GLY A 210
LEU A 306
ALA A  61
PHE A 134
 None
 1.07A 3gwwA-4iwsA:
undetectable		 3gwwA-4iwsA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jg3 CATABOLITE
REPRESSION CONTROL
PROTEIN

(Pseudomonas
aeruginosa) 		PF03372
(Exo_endo_phos) 		5 LEU A  22
GLY A  21
LEU A  23
ILE A  14
PHE A  51
 None
 1.01A 3gwwA-4jg3A:
undetectable		 3gwwA-4jg3A:
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.
4m4d LIPOPOLYSACCHARIDE-B
INDING PROTEIN

(Mus musculus) 		PF01273
(LBP_BPI_CETP)
PF02886
(LBP_BPI_CETP_C) 		5 LEU A  50
GLY A  46
ILE A 201
ALA A 104
ASP A 141
 PC1  A 506 ( 4.5A)
PC1  A 506 (-3.4A)
None
None
None
 1.02A 3gwwA-4m4dA:
undetectable		 3gwwA-4m4dA:
22.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m8k HYPOTHETICAL
PROTEIN, GDSL-LIKE
LIPASE/ACYLHYDROLASE
FAMILY PROTEIN

(Bacteroides
uniformis) 		PF16255
(Lipase_GDSL_lke) 		5 LEU A 112
GLY A 113
TYR A 164
ILE A 118
ASP A 116
 None
 1.02A 3gwwA-4m8kA:
undetectable		 3gwwA-4m8kA:
18.38
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.
4noz ORGANIC
HYDROPEROXIDE
RESISTANCE PROTEIN

(Burkholderia
cenocepacia) 		PF02566
(OsmC) 		5 LEU A 108
GLY A 107
LEU A 105
ILE A  76
ALA A  81
 None
 1.06A 3gwwA-4nozA:
undetectable		 3gwwA-4nozA:
15.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4oog RIBONUCLEASE 3

(Saccharomyces
cerevisiae) 		PF00035
(dsrm)
PF00636
(Ribonuclease_3) 		5 GLY C 407
LEU C 383
ARG C 384
ALA C 381
ASP C 457
 None
None
None
C  D  19 ( 3.4A)
None
 1.07A 3gwwA-4oogC:
undetectable		 3gwwA-4oogC:
19.75
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.
4p3z COPN

(Chlamydia
pneumoniae) 		PF07201
(HrpJ) 		5 LEU A 115
GLY A 114
GLN A 110
ILE A 136
ALA A 101
 None
None
GOL  A 407 (-3.0A)
None
GOL  A 407 (-2.7A)
 1.06A 3gwwA-4p3zA:
0.7		 3gwwA-4p3zA:
22.46
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.
4p3z COPN

(Chlamydia
pneumoniae) 		PF07201
(HrpJ) 		5 LEU A 115
GLY A 114
LEU A 112
GLN A 110
ILE A 136
 None
None
None
GOL  A 407 (-3.0A)
None
 0.95A 3gwwA-4p3zA:
0.7		 3gwwA-4p3zA:
22.46
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.
4q5n GLUTHATIONE
S-TRANSFERASE BLO T
8 ISOFORM

(Blomia
tropicalis) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		5 GLY A  13
LEU A 223
ARG A  12
TYR A 175
ASP A 177
 None
 1.03A 3gwwA-4q5nA:
undetectable		 3gwwA-4q5nA:
18.80
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.
4qmg STAPHYLOCOCCAL
NUCLEASE
DOMAIN-CONTAINING
PROTEIN 1

(Homo sapiens) 		PF00565
(SNase) 		5 LEU A 223
GLY A 275
ILE A 226
ALA A 308
ASP A 298
 None
 1.11A 3gwwA-4qmgA:
undetectable		 3gwwA-4qmgA:
20.95
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.
4rck HYPOTHETICAL
MEMBRANE SPANNING
PROTEIN

(Aliivibrio
fischeri) 		PF00092
(VWA) 		5 LEU A  63
GLY A  64
LEU A  20
ILE A  55
ASP A  90
 None
 0.78A 3gwwA-4rckA:
undetectable		 3gwwA-4rckA:
16.99
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rqb HYPOXANTHINE
PHOSPHORIBOSYLTRANSF
ERASE

(Staphylococcus
aureus) 		PF00156
(Pribosyltran) 		5 LEU A 113
GLY A 110
ARG A 140
ILE A 130
ASP A 135
 UNL  A 202 ( 4.1A)
UNL  A 202 ( 3.1A)
None
None
None
 1.06A 3gwwA-4rqbA:
undetectable		 3gwwA-4rqbA:
17.09
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.
4s13 FERULIC ACID
DECARBOXYLASE 1

(Saccharomyces
cerevisiae) 		PF01977
(UbiD) 		5 LEU A  88
GLY A  89
LEU A  90
ILE A  99
ASP A  80
 None
 1.09A 3gwwA-4s13A:
undetectable		 3gwwA-4s13A:
22.82
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4us4 TRANSPORTER

(Bacillus
halodurans) 		PF00209
(SNF) 		7 LEU A  29
GLY A  30
ARG A  34
TYR A 108
PHE A 230
ASP A 382
ASP A 385
 None
TRP  A 601 (-3.1A)
None
TRP  A 601 (-4.8A)
TRP  A 601 (-4.4A)
None
None
 0.77A 3gwwA-4us4A:
41.0		 3gwwA-4us4A:
33.08
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4us4 TRANSPORTER

(Bacillus
halodurans) 		PF00209
(SNF) 		7 LEU A  29
GLY A  30
TYR A 108
ILE A 111
PHE A 230
ASP A 382
ASP A 385
 None
TRP  A 601 (-3.1A)
TRP  A 601 (-4.8A)
None
TRP  A 601 (-4.4A)
None
None
 0.60A 3gwwA-4us4A:
41.0		 3gwwA-4us4A:
33.08
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.
4xbz EVDO1

(Micromonospora
carbonacea) 		PF05721
(PhyH) 		5 LEU A  42
GLY A  41
LEU A  43
ILE A 162
ASP A 165
 None
 1.01A 3gwwA-4xbzA:
undetectable		 3gwwA-4xbzA:
22.59
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.
4xhj ENVELOPE
GLYCOPROTEIN H
ENVELOPE
GLYCOPROTEIN L

(Human
alphaherpesvirus
3) 		PF02489
(Herpes_glycop_H)
PF05259
(Herpes_UL1)
PF17488
(Herpes_glycoH_C) 		5 LEU B 107
GLY B 106
LEU B 104
ILE B  74
PHE A 132
 None
 0.81A 3gwwA-4xhjB:
undetectable		 3gwwA-4xhjB:
12.35
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.
4zaj ARGININE--TRNA
LIGASE, CYTOPLASMIC

(Homo sapiens) 		PF00750
(tRNA-synt_1d)
PF03485
(Arg_tRNA_synt_N)
PF05746
(DALR_1) 		5 LEU A 394
GLY A 395
TYR A 428
ILE A 431
PHE A 446
 None
 1.11A 3gwwA-4zajA:
2.1		 3gwwA-4zajA:
21.26
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.
5aip TRANSCRIPTIONAL
REGULATOR, MARR
FAMILY

(Neisseria
meningitidis) 		PF01047
(MarR) 		5 LEU A  71
GLY A  69
LEU A  67
ILE A  41
ASP A  36
 None
 0.87A 3gwwA-5aipA:
2.0		 3gwwA-5aipA:
15.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5c98 AGAP007691-PB

(Anopheles
gambiae) 		PF00079
(Serpin) 		5 GLY A 303
LEU A 305
PHE A 311
ALA A  77
PHE A  33
 None
 0.95A 3gwwA-5c98A:
undetectable		 3gwwA-5c98A:
21.92
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.
5dn8 GTPASE DER

(Coxiella
burnetii) 		PF01926
(MMR_HSR1)
PF14714
(KH_dom-like) 		5 LEU A 191
GLY A 187
ILE A 326
ALA A 267
ASP A 297
 None
GDP  A 501 (-3.4A)
None
None
GDP  A 501 (-2.9A)
 1.08A 3gwwA-5dn8A:
undetectable		 3gwwA-5dn8A:
22.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5f5o NUCLEOPROTEIN

(Marburg
marburgvirus) 		PF05505
(Ebola_NP) 		5 LEU A  51
GLY A  49
TYR A 109
ILE A 103
ALA A  41
 None
 0.95A 3gwwA-5f5oA:
undetectable		 3gwwA-5f5oA:
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.
5f7c ALPHA-GLUCOSIDASE

(Bacteroides
thetaiotaomicron) 		PF01055
(Glyco_hydro_31)
PF13802
(Gal_mutarotas_2) 		5 LEU A 543
GLY A 207
LEU A 245
ILE A 638
ASP A 216
 None
 1.02A 3gwwA-5f7cA:
undetectable		 3gwwA-5f7cA:
21.42
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.
5fo5 HTH-TYPE
TRANSCRIPTIONAL
REGULATOR METR

(Escherichia
coli) 		PF00126
(HTH_1) 		6 LEU A  48
GLY A  62
LEU A  65
GLN A  67
PHE A  58
ALA A  69
 None
 1.36A 3gwwA-5fo5A:
undetectable		 3gwwA-5fo5A:
9.47
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.
5fvd NUCLEOCAPSID

(Human
metapneumovirus) 		PF03246
(Pneumo_ncap) 		5 LEU A 371
GLY A 370
LEU A 369
ILE A 334
ALA A 265
 None
 1.04A 3gwwA-5fvdA:
undetectable		 3gwwA-5fvdA:
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.
5h2v IMPORTIN SUBUNIT
BETA-3

(Saccharomyces
cerevisiae) 		PF13513
(HEAT_EZ) 		5 LEU A 216
GLY A 217
LEU A 219
TYR A 204
PHE A 186
 None
 1.02A 3gwwA-5h2vA:
undetectable		 3gwwA-5h2vA:
19.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jjh 4-ALPHA-GLUCANOTRANS
FERASE

(Corynebacterium
glutamicum) 		PF02446
(Glyco_hydro_77) 		5 LEU A 146
GLY A 158
LEU A 159
ILE A 101
ASP A 105
 None
 1.07A 3gwwA-5jjhA:
undetectable		 3gwwA-5jjhA:
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.
5k5t EXTRACELLULAR
CALCIUM-SENSING
RECEPTOR

(Homo sapiens) 		PF01094
(ANF_receptor)
PF07562
(NCD3G) 		5 GLY A  35
LEU A  34
ARG A  96
GLN A  27
ILE A 139
 None
 1.00A 3gwwA-5k5tA:
undetectable		 3gwwA-5k5tA:
20.92
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.
5tgd FOLM ALTERNATIVE
DIHYDROFOLATE
REDUCTASE

(Brucella suis) 		PF00106
(adh_short) 		5 LEU A 149
GLY A 148
LEU A  99
ARG A  98
PHE A  45
 None
 1.10A 3gwwA-5tgdA:
undetectable		 3gwwA-5tgdA:
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.
5x3j GLYCOSIDE HYDROLASE
FAMILY 31

(Kribbella
flavida) 		no annotation 5 LEU A 274
TYR A 541
ILE A 511
PHE A 279
ALA A 310
 None
 0.99A 3gwwA-5x3jA:
undetectable		 3gwwA-5x3jA:
8.37
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.
5xsq NUCLEOPROTEIN

(Marburg
marburgvirus) 		PF05505
(Ebola_NP) 		5 LEU A  35
GLY A  33
TYR A  93
ILE A  87
ALA A  25
 None
 1.01A 3gwwA-5xsqA:
undetectable		 3gwwA-5xsqA:
22.01
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.
5xya -

(-) 		no annotation 5 LEU A 833
GLY A 837
ILE A 830
PHE A 843
ASP A 850
 None
 1.00A 3gwwA-5xyaA:
undetectable		 3gwwA-5xyaA:
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.
5xya -

(-) 		no annotation 5 LEU A 833
GLY A 837
ILE A 830
PHE A 843
ASP A 851
 None
 1.06A 3gwwA-5xyaA:
undetectable		 3gwwA-5xyaA:
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.
5yj6 DOCKERIN TYPE I
REPEAT-CONTAINING
PROTEIN

(Ruminiclostridium
thermocellum) 		no annotation 5 LEU A 527
LEU A 556
ILE A 487
ALA A 560
PHE A 485
 None
 0.97A 3gwwA-5yj6A:
undetectable		 3gwwA-5yj6A:
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.
6brm PUTATIVE
METAL-DEPENDENT
ISOTHIOCYANATE
HYDROLASE SAXA

(Pectobacterium
carotovorum) 		no annotation 5 LEU A 109
ARG A 107
ILE A 121
ALA A  62
PHE A  20
 None
 1.05A 3gwwA-6brmA:
undetectable		 3gwwA-6brmA:
9.76
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.
6ckt 2,3,4,5-TETRAHYDROPY
RIDINE-2,6-DICARBOXY
LATE
N-SUCCINYLTRANSFERAS
E

(Legionella
pneumophila) 		no annotation 5 GLY A 166
LEU A 168
ILE A 130
PHE A  67
ASP A  84
 None
EDO  A 302 ( 4.4A)
None
EDO  A 302 (-4.3A)
None
 1.11A 3gwwA-6cktA:
undetectable		 3gwwA-6cktA:
8.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6d95 -

(-) 		no annotation 5 LEU A  96
LEU A  95
ARG A  97
PHE A  60
ASP A 101
 None
 1.09A 3gwwA-6d95A:
undetectable		 3gwwA-6d95A:
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.
6dll P-HYDROXYBENZOATE
HYDROXYLASE

(Pseudomonas
putida) 		no annotation 5 LEU A 281
GLY A 279
LEU A 132
ILE A 155
ASP A 151
 None
 1.04A 3gwwA-6dllA:
undetectable		 3gwwA-6dllA:
9.71
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.
6fik POLYKETIDE SYNTHASE

(Cercospora
nicotianae) 		no annotation 5 LEU A1185
GLY A1184
LEU A1186
ILE A1144
ALA A1208
 None
 1.00A 3gwwA-6fikA:
0.6		 3gwwA-6fikA:
10.10
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.
6g2j NADH DEHYDROGENASE
[UBIQUINONE] 1 BETA
SUBCOMPLEX SUBUNIT
10
NADH-UBIQUINONE
OXIDOREDUCTASE CHAIN
4

(Mus musculus) 		no annotation 5 LEU M  61
GLY M 456
LEU M 457
ILE M 244
ALA p 147
 None
 1.10A 3gwwA-6g2jM:
undetectable		 3gwwA-6g2jM:
10.35