SIMILAR PATTERNS OF AMINO ACIDS FOR 5IGI_A_ZITA402_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.
1al8 GLYCOLATE OXIDASE

(Spinacia
oleracea) 		PF01070
(FMN_dh) 		5 MET A  74
ILE A 102
VAL A 305
ALA A 302
GLY A 278
 None
 1.06A 5igiA-1al8A:
0.0		 5igiA-1al8A:
25.46
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.
1aug PYROGLUTAMYL
PEPTIDASE-1

(Bacillus
amyloliquefaciens) 		PF01470
(Peptidase_C15) 		5 ASP A 206
ALA A 200
VAL A 198
GLY A 165
THR A 115
 None
 1.25A 5igiA-1augA:
0.0		 5igiA-1augA:
23.28
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.
1coy CHOLESTEROL OXIDASE

(Brevibacterium
sterolicum) 		PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C) 		5 ILE A  39
ALA A 494
MET A 498
GLY A 462
THR A 458
 None
 1.27A 5igiA-1coyA:
0.0		 5igiA-1coyA:
21.79
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.
1ezv UBIQUINOL-CYTOCHROME
C REDUCTASE COMPLEX
CORE PROTEIN I

(Saccharomyces
cerevisiae) 		PF00675
(Peptidase_M16)
PF05193
(Peptidase_M16_C) 		5 VAL A 362
ALA A 280
VAL A 417
GLY A 328
PHE A 314
 None
 1.25A 5igiA-1ezvA:
0.0		 5igiA-1ezvA:
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.
1fpw CALCIUM-BINDING
PROTEIN NCS-1

(Saccharomyces
cerevisiae) 		PF13499
(EF-hand_7)
PF13833
(EF-hand_8) 		5 MET A 121
ILE A 116
ASP A 187
VAL A 125
ALA A 182
 None
CA  A 501 (-4.6A)
None
None
None
 0.99A 5igiA-1fpwA:
undetectable		 5igiA-1fpwA:
21.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hdg HOLO-D-GLYCERALDEHYD
E-3-PHOSPHATE
DEHYDROGENASE

(Thermotoga
maritima) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 ILE O 167
ALA O 262
MET O 259
VAL O 258
GLY O 272
 None
 1.25A 5igiA-1hdgO:
0.0		 5igiA-1hdgO:
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.
1hrd GLUTAMATE
DEHYDROGENASE

([Clostridium]
symbiosum) 		PF00208
(ELFV_dehydrog)
PF02812
(ELFV_dehydrog_N) 		5 ILE A  53
ASP A  17
TYR A  15
VAL A  11
VAL A  25
 None
 0.99A 5igiA-1hrdA:
undetectable		 5igiA-1hrdA:
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.
1jof CARBOXY-CIS,CIS-MUCO
NATE CYCLASE

(Neurospora
crassa) 		PF10282
(Lactonase) 		5 ASP A 329
ALA A 313
VAL A 259
THR A 306
PHE A 278
 None
 1.24A 5igiA-1jofA:
0.0		 5igiA-1jofA:
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.
1kb0 QUINOHEMOPROTEIN
ALCOHOL
DEHYDROGENASE

(Comamonas
testosteroni) 		PF13360
(PQQ_2)
PF13442
(Cytochrome_CBB3) 		5 ILE A  32
VAL A 131
VAL A  89
GLY A 138
THR A 156
 None
 1.24A 5igiA-1kb0A:
undetectable		 5igiA-1kb0A:
19.17
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.
1l5j ACONITATE HYDRATASE
2

(Escherichia
coli) 		PF00330
(Aconitase)
PF06434
(Aconitase_2_N)
PF11791
(Aconitase_B_N) 		5 ILE A 581
ASP A 689
VAL A 550
GLY A 243
THR A 242
 None
 1.18A 5igiA-1l5jA:
0.0		 5igiA-1l5jA:
17.97
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.
1mw9 DNA TOPOISOMERASE I

(Escherichia
coli) 		PF01131
(Topoisom_bac)
PF01751
(Toprim) 		5 VAL X 510
ALA X 200
VAL X 204
GLY X 492
THR X 496
 None
 1.25A 5igiA-1mw9X:
undetectable		 5igiA-1mw9X:
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.
1oi7 SUCCINYL-COA
SYNTHETASE ALPHA
CHAIN

(Thermus
thermophilus) 		PF00549
(Ligase_CoA)
PF02629
(CoA_binding) 		5 ILE A 136
TYR A 158
ALA A 161
VAL A 141
GLY A 148
 None
 1.20A 5igiA-1oi7A:
undetectable		 5igiA-1oi7A:
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.
1osg TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B

(Homo sapiens) 		PF00229
(TNF) 		5 ILE A 212
VAL A 199
ALA A 151
VAL A 166
PHE A 172
 None
 1.02A 5igiA-1osgA:
undetectable		 5igiA-1osgA:
23.97
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.
1qgc PROTEIN (VIRUS
CAPSID PROTEIN VP1)
PROTEIN (VIRUS
CAPSID PROTEIN VP2)

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		5 ILE 2 197
VAL 2 109
VAL 2 123
GLY 1   5
THR 1   4
 None
 1.03A 5igiA-1qgc2:
undetectable		 5igiA-1qgc2:
21.57
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.
1qge PROTEIN
(TRIACYLGLYCEROL
HYDROLASE)

(Burkholderia
glumae) 		PF00561
(Abhydrolase_1) 		5 ILE D 214
ALA D 141
VAL D 138
GLY D 147
THR D 148
 None
 1.11A 5igiA-1qgeD:
undetectable		 5igiA-1qgeD:
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.
1rqb TRANSCARBOXYLASE 5S
SUBUNIT

(Propionibacterium
freudenreichii) 		PF00682
(HMGL-like)
PF02436
(PYC_OADA) 		5 ASP A 185
VAL A 238
VAL A 257
GLY A 221
THR A 220
 None
 1.23A 5igiA-1rqbA:
undetectable		 5igiA-1rqbA:
21.80
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.
1tah LIPASE

(Burkholderia
glumae) 		no annotation 5 ILE B 214
ALA B 141
VAL B 138
GLY B 147
THR B 148
 None
 1.17A 5igiA-1tahB:
undetectable		 5igiA-1tahB:
24.14
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.
1ulz PYRUVATE CARBOXYLASE
N-TERMINAL DOMAIN

(Aquifex
aeolicus) 		PF00289
(Biotin_carb_N)
PF02785
(Biotin_carb_C)
PF02786
(CPSase_L_D2) 		5 ILE A  51
VAL A  29
ALA A  74
VAL A  72
GLY A  98
 None
 0.95A 5igiA-1ulzA:
undetectable		 5igiA-1ulzA:
20.76
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.
1w5e FTSZ

(Methanocaldococcus
jannaschii) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 ILE A 150
VAL A  67
GLY A  63
THR A 227
PHE A 236
 None
 1.23A 5igiA-1w5eA:
undetectable		 5igiA-1w5eA:
23.73
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.
1zly PHOSPHORIBOSYLGLYCIN
AMIDE
FORMYLTRANSFERASE

(Homo sapiens) 		PF00551
(Formyl_trans_N) 		5 ILE A 107
ALA A  28
VAL A   3
GLY A 187
THR A 188
 GRF  A1300 (-4.5A)
None
None
None
None
 1.20A 5igiA-1zlyA:
undetectable		 5igiA-1zlyA:
23.28
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.
2azp HYPOTHETICAL PROTEIN
PA1268

(Pseudomonas
aeruginosa) 		PF05544
(Pro_racemase) 		5 ILE A 198
VAL A 189
VAL A 167
GLY A 239
THR A 238
 None
 1.22A 5igiA-2azpA:
undetectable		 5igiA-2azpA:
23.82
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.
2bq8 TARTRATE-RESISTANT
ACID PHOSPHATASE
TYPE 5

(Homo sapiens) 		PF00149
(Metallophos) 		5 ILE X 131
VAL X 274
ALA X 272
VAL X 235
GLY X 240
 None
 1.18A 5igiA-2bq8X:
undetectable		 5igiA-2bq8X:
22.00
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.
2d9y PLECKSTRIN HOMOLOGY
DOMAIN-CONTAINING
PROTEIN FAMILY A
MEMBER 6

(Homo sapiens) 		PF00169
(PH) 		5 ILE A  51
VAL A  11
GLY A 105
PHE A  60
TYR A  87
 None
 1.26A 5igiA-2d9yA:
undetectable		 5igiA-2d9yA:
15.79
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.
2eo5 419AA LONG
HYPOTHETICAL
AMINOTRANSFERASE

(Sulfurisphaera
tokodaii) 		PF00202
(Aminotran_3) 		5 VAL A 124
VAL A 250
GLY A 141
THR A 143
PHE A 144
 None
None
PLP  A1001 ( 4.2A)
None
None
 1.21A 5igiA-2eo5A:
undetectable		 5igiA-2eo5A:
20.14
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.
2f5v PYRANOSE 2-OXIDASE

(Peniophora sp.
SG) 		PF05199
(GMC_oxred_C) 		5 ILE A 295
ALA A 320
VAL A  52
GLY A 584
THR A 552
 None
FAD  A1625 (-3.6A)
FAD  A1625 (-4.8A)
None
None
 1.22A 5igiA-2f5vA:
undetectable		 5igiA-2f5vA:
18.34
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.
2fep CATABOLITE CONTROL
PROTEIN A

(Bacillus
subtilis) 		PF13377
(Peripla_BP_3) 		5 VAL A 184
ALA A 252
THR A 278
PHE A  75
TYR A  76
 None
None
SO4  A4396 (-2.9A)
SO4  A4397 ( 3.2A)
SO4  A4397 (-4.5A)
 1.25A 5igiA-2fepA:
undetectable		 5igiA-2fepA:
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.
2iyo 6-PHOSPHOGLUCONATE
DEHYDROGENASE,
DECARBOXYLATING

(Lactococcus
lactis) 		PF00393
(6PGD)
PF03446
(NAD_binding_2) 		5 ALA A 172
MET A 174
GLY A 356
THR A 377
TYR A 335
 None
 1.11A 5igiA-2iyoA:
1.2		 5igiA-2iyoA:
21.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ldx APO-LACTATE
DEHYDROGENASE

(Mus musculus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ILE A 199
VAL A 303
VAL A 269
GLY A 159
THR A 143
 None
 1.08A 5igiA-2ldxA:
undetectable		 5igiA-2ldxA:
24.15
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.
2o56 PUTATIVE MANDELATE
RACEMASE

(Salmonella
enterica) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ILE A 344
VAL A 214
ALA A 158
VAL A 162
GLY A 138
 None
 1.22A 5igiA-2o56A:
undetectable		 5igiA-2o56A:
22.11
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.
2w40 GLYCEROL KINASE,
PUTATIVE

(Plasmodium
falciparum) 		PF00370
(FGGY_N)
PF02782
(FGGY_C) 		5 MET A 211
GLY A 129
THR A 130
PHE A 132
TYR A 119
 None
None
EDO  A1506 (-4.1A)
None
EDO  A1509 (-4.8A)
 1.21A 5igiA-2w40A:
undetectable		 5igiA-2w40A:
20.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2xf8 D-ERYTHROSE-4-PHOSPH
ATE DEHYDROGENASE

(Escherichia
coli) 		PF00044
(Gp_dh_N)
PF02800
(Gp_dh_C) 		5 ILE A 214
VAL A 157
ALA A 290
VAL A 309
GLY A 316
 None
 1.01A 5igiA-2xf8A:
undetectable		 5igiA-2xf8A:
23.24
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.
2yhg CELLULOSE-BINDING
PROTEIN

(Saccharophagus
degradans) 		PF07632
(DUF1593) 		5 ASP A 685
ALA A 654
VAL A 657
GLY A 609
THR A 561
 None
 1.25A 5igiA-2yhgA:
undetectable		 5igiA-2yhgA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2ywb GMP SYNTHASE
[GLUTAMINE-HYDROLYZI
NG]

(Thermus
thermophilus) 		PF00117
(GATase)
PF00958
(GMP_synt_C) 		5 ILE A  15
ALA A 184
VAL A 186
GLY A  71
PHE A  68
 None
 1.19A 5igiA-2ywbA:
undetectable		 5igiA-2ywbA:
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.
2zal L-ASPARAGINASE

(Escherichia
coli) 		PF01112
(Asparaginase_2) 		5 VAL B 214
ALA A  96
MET A 121
VAL A 120
GLY A  99
 None
 1.25A 5igiA-2zalB:
undetectable		 5igiA-2zalB:
22.11
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.
3cl6 PUUE ALLANTOINASE

(Pseudomonas
fluorescens) 		PF01522
(Polysacc_deac_1) 		5 ILE A  86
VAL A 112
ALA A 106
GLY A 127
TYR A 211
 None
 1.06A 5igiA-3cl6A:
undetectable		 5igiA-3cl6A:
19.94
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.
3e53 FATTY-ACID-COA
LIGASE FADD28

(Mycobacterium
tuberculosis) 		PF00501
(AMP-binding) 		5 ILE A 457
ASP A 222
VAL A 338
ALA A 334
VAL A 405
 None
 1.12A 5igiA-3e53A:
undetectable		 5igiA-3e53A:
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.
3e53 FATTY-ACID-COA
LIGASE FADD28

(Mycobacterium
tuberculosis) 		PF00501
(AMP-binding) 		5 ILE A 457
VAL A 338
ALA A 334
VAL A 405
THR A 171
 None
 1.23A 5igiA-3e53A:
undetectable		 5igiA-3e53A:
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.
3e74 ALLANTOINASE

(Escherichia
coli) 		PF01979
(Amidohydro_1) 		5 ILE A 418
ALA A 336
GLY A  76
THR A  75
TYR A 433
 None
 0.94A 5igiA-3e74A:
undetectable		 5igiA-3e74A:
21.04
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.
3e7o MITOGEN-ACTIVATED
PROTEIN KINASE 9

(Homo sapiens) 		PF00069
(Pkinase) 		5 ILE A 214
VAL A 118
ALA A 113
VAL A 159
GLY A  33
 None
None
35F  A   1 (-4.9A)
None
35F  A   1 ( 4.8A)
 1.10A 5igiA-3e7oA:
7.3		 5igiA-3e7oA:
20.81
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.
3fd0 PUTATIVE
CYSTATHIONINE
BETA-LYASE INVOLVED
IN ALUMINUM
RESISTANCE

(Listeria
innocua) 		PF06838
(Met_gamma_lyase) 		5 VAL A 387
ALA A 331
MET A 327
GLY A 348
TYR A 354
 None
 1.10A 5igiA-3fd0A:
undetectable		 5igiA-3fd0A:
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.
3juj UDP-GLUCOSE
PYROPHOSPHORYLASE
(GALU)

(Helicobacter
pylori) 		PF00483
(NTP_transferase) 		5 ILE A 230
ALA A  10
VAL A  54
GLY A  13
THR A  14
 None
 1.09A 5igiA-3jujA:
undetectable		 5igiA-3jujA:
20.19
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.
3n79 PDUT

(Salmonella
enterica) 		PF00936
(BMC) 		5 ILE A 109
ASP A  70
VAL A  33
GLY A  60
THR A  61
 None
 1.23A 5igiA-3n79A:
undetectable		 5igiA-3n79A:
23.68
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.
3nhi D7 PROTEIN

(Anopheles
stephensi) 		PF01395
(PBP_GOBP) 		5 ILE A  75
TYR A 117
VAL A 120
ALA A 116
GLY A 108
 None
EAH  A   1 (-4.6A)
None
None
None
 1.07A 5igiA-3nhiA:
1.7		 5igiA-3nhiA:
21.75
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p41 GERANYLTRANSTRANSFER
ASE

(Pseudomonas
protegens) 		PF00348
(polyprenyl_synt) 		5 ASP A 222
VAL A 291
ALA A 217
GLY A 182
THR A 181
 None
 1.11A 5igiA-3p41A:
undetectable		 5igiA-3p41A:
23.17
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.
3rpc POSSIBLE
METAL-DEPENDENT
HYDROLASE

(Veillonella
parvula) 		PF12706
(Lactamase_B_2) 		5 MET A 186
ILE A 219
VAL A 163
ALA A 175
VAL A 172
 None
 1.10A 5igiA-3rpcA:
undetectable		 5igiA-3rpcA:
21.12
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.
3u7i FMN-DEPENDENT
NADH-AZOREDUCTASE 1

(Bacillus
anthracis) 		PF02525
(Flavodoxin_2) 		5 ILE A  85
VAL A  78
ALA A  61
VAL A  58
GLY A  66
 None
 1.26A 5igiA-3u7iA:
undetectable		 5igiA-3u7iA:
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.
3ubo ADENOSINE KINASE

(Sinorhizobium
meliloti) 		PF00294
(PfkB) 		5 ILE A 211
VAL A   6
ALA A  65
VAL A  68
GLY A  59
 None
None
None
None
ADN  A 353 (-3.2A)
 1.08A 5igiA-3uboA:
undetectable		 5igiA-3uboA:
22.44
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.
3vgl GLUCOKINASE

(Streptomyces
griseus) 		PF00480
(ROK) 		5 ILE A  44
VAL A 102
VAL A  75
GLY A 135
THR A 129
 None
None
None
BGC  A 324 (-3.5A)
None
 1.22A 5igiA-3vglA:
undetectable		 5igiA-3vglA:
24.14
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.
3vs8 TYPE III POLYKETIDE
SYNTHASE

(Azotobacter
vinelandii) 		PF02797
(Chal_sti_synt_C) 		5 VAL A 178
ALA A 164
MET A 167
VAL A 168
GLY A 135
 None
 1.02A 5igiA-3vs8A:
undetectable		 5igiA-3vs8A:
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.
3vu2 1,4-ALPHA-GLUCAN-BRA
NCHING ENZYME,
CHLOROPLASTIC/AMYLOP
LASTIC

(Oryza sativa) 		PF00128
(Alpha-amylase)
PF02806
(Alpha-amylase_C)
PF02922
(CBM_48) 		5 ILE A 211
ASP A 270
VAL A 267
VAL A 257
PHE A 233
 None
 1.23A 5igiA-3vu2A:
undetectable		 5igiA-3vu2A:
18.91
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.
3zou FARNESYL
PYROPHOSPHATE
SYNTHASE

(Pseudomonas
aeruginosa) 		PF00348
(polyprenyl_synt) 		6 ILE A   2
ASP A 222
VAL A 291
ALA A 217
GLY A 182
THR A 181
 6H6  A1299 ( 4.1A)
None
None
None
None
None
 1.25A 5igiA-3zouA:
undetectable		 5igiA-3zouA:
26.13
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.
3zwf ZINC
PHOSPHODIESTERASE
ELAC PROTEIN 1

(Homo sapiens) 		PF00753
(Lactamase_B)
PF12706
(Lactamase_B_2) 		5 ILE A 359
VAL A 310
GLY A 252
THR A  61
PHE A  59
 None
 1.11A 5igiA-3zwfA:
undetectable		 5igiA-3zwfA:
23.41
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4bgv MALATE DEHYDROGENASE

(Picrophilus
torridus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 ALA A 258
VAL A 286
GLY A 151
PHE A 188
TYR A 191
 None
 1.09A 5igiA-4bgvA:
undetectable		 5igiA-4bgvA:
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.
4bhd SERINE
HYDROXYMETHYLTRANSFE
RASE

(Methanocaldococcus
jannaschii) 		PF00464
(SHMT) 		5 ILE A 132
ASP A 196
ALA A 113
VAL A 137
GLY A 119
 None
 1.03A 5igiA-4bhdA:
0.2		 5igiA-4bhdA:
22.93
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.
4cw4 BETA-KETOACYL
SYNTHASE

(Pseudomonas
aeruginosa) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 ILE A 292
VAL A   6
ALA A 550
MET A 553
THR A 424
 None
 1.12A 5igiA-4cw4A:
undetectable		 5igiA-4cw4A:
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.
4e3a SUGAR KINASE PROTEIN

(Rhizobium etli) 		PF00294
(PfkB) 		5 ILE A 209
VAL A   4
ALA A  63
VAL A  66
GLY A  57
 None
None
None
None
ADN  A 500 (-3.7A)
 1.06A 5igiA-4e3aA:
undetectable		 5igiA-4e3aA:
23.04
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.
4es7 PROTEIN AMBP

(Homo sapiens) 		PF00061
(Lipocalin) 		5 MET A 156
ILE A  23
VAL A  39
GLY A  16
TYR A  72
 None
 1.13A 5igiA-4es7A:
undetectable		 5igiA-4es7A:
20.81
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.
4exj UNCHARACTERIZED
PROTEIN

(Lodderomyces
elongisporus) 		PF00043
(GST_C)
PF13417
(GST_N_3) 		5 ILE A  69
VAL A  17
VAL A 168
PHE A  31
TYR A  43
 None
 1.19A 5igiA-4exjA:
undetectable		 5igiA-4exjA:
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.
4g9k ROTENONE-INSENSITIVE
NADH-UBIQUINONE
OXIDOREDUCTASE

(Saccharomyces
cerevisiae) 		PF07992
(Pyr_redox_2) 		5 ILE A 298
VAL A 277
GLY A 470
THR A 474
PHE A 475
 ILE  A 298 ( 0.7A)
VAL  A 277 ( 0.6A)
GLY  A 470 ( 0.0A)
THR  A 474 ( 0.8A)
PHE  A 475 ( 1.3A)
 1.22A 5igiA-4g9kA:
undetectable		 5igiA-4g9kA:
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.
4gh4 CAPSID PROTEIN VP1
CAPSID PROTEIN VP2

(Foot-and-mouth
disease virus) 		PF00073
(Rhv) 		5 ILE B 197
VAL B 109
VAL B 123
GLY A   5
THR A   4
 None
 1.04A 5igiA-4gh4B:
undetectable		 5igiA-4gh4B:
19.94
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.
4hyd PUTATIVE
UNCHARACTERIZED
PROTEIN

(Methanoculleus
marisnigri) 		PF06550
(SPP) 		5 ILE A 222
MET A  30
VAL A  27
GLY A  90
PHE A  85
 None
 1.23A 5igiA-4hydA:
undetectable		 5igiA-4hydA:
23.93
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.
4ix8 TYROSINE
AMINOTRANSFERASE

(Leishmania
infantum) 		PF00155
(Aminotran_1_2) 		5 ILE A 154
VAL A 170
ALA A 172
GLY A 412
PHE A 378
 None
 1.23A 5igiA-4ix8A:
undetectable		 5igiA-4ix8A:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4jn7 ENOLASE

(Agrobacterium
tumefaciens) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 MET A 275
ILE A 266
ALA A 282
PHE A 214
TYR A 120
 None
 1.25A 5igiA-4jn7A:
undetectable		 5igiA-4jn7A:
22.64
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.
4kvl FATTY ACID
ALPHA-OXIDASE

(Oryza sativa) 		PF03098
(An_peroxidase) 		5 ILE A 519
ASP A 471
VAL A 177
ALA A 173
GLY A 170
 None
 1.24A 5igiA-4kvlA:
undetectable		 5igiA-4kvlA:
18.14
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.
4lxi MCP HYDROLASE

(Sphingomonas
wittichii) 		PF12697
(Abhydrolase_6) 		5 MET A 258
VAL A 257
GLY A  40
PHE A  65
TYR A 193
 None
 1.24A 5igiA-4lxiA:
undetectable		 5igiA-4lxiA:
19.76
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.
4m1r CELLULASE 5

(soil metagenome) 		PF00150
(Cellulase) 		5 ASP A  95
ALA A 101
GLY A 165
THR A 190
TYR A 194
 None
 1.20A 5igiA-4m1rA:
undetectable		 5igiA-4m1rA:
21.88
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4mae METHANOL
DEHYDROGENASE

(Methylacidiphilum
fumariolicum) 		PF13360
(PQQ_2) 		5 ILE A 508
VAL A 107
ALA A 103
GLY A 171
THR A 236
 None
None
None
PQQ  A 602 (-3.1A)
PQQ  A 602 (-3.1A)
 1.19A 5igiA-4maeA:
undetectable		 5igiA-4maeA:
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.
4q3r ARGINASE

(Schistosoma
mansoni) 		PF00491
(Arginase) 		5 ILE A 290
ASP A 158
ALA A 306
GLY A 275
THR A 276
 None
MN  A 401 ( 2.5A)
None
None
XA2  A 407 (-3.6A)
 1.10A 5igiA-4q3rA:
undetectable		 5igiA-4q3rA:
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.
4rp8 ASCORBATE-SPECIFIC
PERMEASE IIC
COMPONENT ULAA

(Escherichia
coli) 		PF03611
(EIIC-GAT) 		5 ILE A 192
TYR A 319
VAL A 287
GLY A  60
THR A  63
 None
 1.17A 5igiA-4rp8A:
undetectable		 5igiA-4rp8A:
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.
4rya ABC TRANSPORTER
SUBSTRATE BINDING
PROTEIN (SORBITOL)

(Agrobacterium
vitis) 		PF01547
(SBP_bac_1) 		5 ILE A 369
ASP A 262
ALA A 198
VAL A 387
GLY A 190
 None
None
None
None
MTL  A 501 (-3.6A)
 1.20A 5igiA-4ryaA:
undetectable		 5igiA-4ryaA:
22.43
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.
4u1r ATP-DEPENDENT
6-PHOSPHOFRUCTOKINAS
E, PLATELET TYPE

(Homo sapiens) 		PF00365
(PFK) 		5 VAL A  29
ALA A  42
VAL A  46
THR A 184
PHE A 178
 None
 1.22A 5igiA-4u1rA:
undetectable		 5igiA-4u1rA:
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.
4wct FRUCTOSYL
AMINE:OXYGEN
OXIDOREDUCTASE

(Aspergillus
fumigatus) 		PF01266
(DAO) 		5 MET A 248
ILE A 246
TYR A 256
VAL A 253
THR A 138
 None
 1.23A 5igiA-4wctA:
undetectable		 5igiA-4wctA:
21.01
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.
4xfd NH(3)-DEPENDENT
NAD(+) SYNTHETASE

(Pseudomonas
aeruginosa) 		PF02540
(NAD_synthase) 		5 ALA A 155
VAL A 151
GLY A 162
THR A  46
PHE A  82
 None
 1.15A 5igiA-4xfdA:
undetectable		 5igiA-4xfdA:
23.24
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.
4zch TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13,TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B,TUMOR NECROSIS
FACTOR LIGAND
SUPERFAMILY MEMBER
13B

(Homo sapiens) 		PF00229
(TNF) 		5 ILE A 371
VAL A 358
ALA A 310
VAL A 325
PHE A 331
 None
 1.05A 5igiA-4zchA:
undetectable		 5igiA-4zchA:
22.22
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.
4zn6 1-DEOXY-D-XYLULOSE
5-PHOSPHATE
REDUCTOISOMERASE

(Acinetobacter
baumannii) 		PF02670
(DXP_reductoisom)
PF08436
(DXP_redisom_C)
PF13288
(DXPR_C) 		5 ILE A  54
VAL A  63
VAL A  65
GLY A 115
THR A 119
 None
 1.25A 5igiA-4zn6A:
0.6		 5igiA-4zn6A:
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.
5b2d HN PROTEIN

(Mumps
rubulavirus) 		PF00423
(HN) 		5 TYR A 258
VAL A 259
GLY A 270
PHE A 370
TYR A 369
 None
None
None
SLT  A 606 (-4.6A)
SLT  A 606 (-4.2A)
 1.19A 5igiA-5b2dA:
undetectable		 5igiA-5b2dA:
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.
5d9n B-1,4-ENDOGLUCANASE

(Prevotella
bryantii) 		PF00150
(Cellulase) 		5 VAL A  97
ALA A 107
VAL A 109
GLY A  23
PHE A 328
 None
 1.13A 5igiA-5d9nA:
undetectable		 5igiA-5d9nA:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5dmy BETA-GALACTOSIDASE

(Bifidobacterium
bifidum) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF16355
(DUF4982) 		5 ILE A 538
VAL A 571
ALA A 575
GLY A 531
THR A 509
 None
 1.14A 5igiA-5dmyA:
undetectable		 5igiA-5dmyA:
16.78
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.
5eu0 BARTONELLA EFFECTOR
PROTEIN (BEP)
SUBSTRATE OF VIRB
T4SS

(Bartonella
rochalimae) 		PF02661
(Fic) 		5 ILE A 156
MET A 205
VAL A 208
GLY A 177
PHE A 183
 None
None
None
SO4  A 301 (-3.7A)
None
 1.15A 5igiA-5eu0A:
undetectable		 5igiA-5eu0A:
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.
5feu NOROXOMARITIDINE/NOR
CRAUGSODINE
REDUCTASE

(Narcissus
pseudonarcissus) 		PF13561
(adh_short_C2) 		5 VAL A  42
ALA A  28
VAL A  30
GLY A 155
THR A 154
 None
 1.25A 5igiA-5feuA:
undetectable		 5igiA-5feuA:
19.94
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.
5ghs SSDNA-SPECIFIC
EXONUCLEASE

(Thermococcus
kodakarensis) 		PF02272
(DHHA1) 		5 ILE A  21
ALA A 104
VAL A 102
GLY A  37
THR A  39
 None
 1.13A 5igiA-5ghsA:
undetectable		 5igiA-5ghsA:
20.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h82 HETEROYOHIMBINE
SYNTHASE THAS2

(Catharanthus
roseus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 MET A 341
ILE A 364
ASP A  51
ALA A  16
THR A 124
 None
 1.24A 5igiA-5h82A:
undetectable		 5igiA-5h82A:
22.03
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5igp MACROLIDE
2'-PHOSPHOTRANSFERAS
E

(Escherichia
coli) 		PF01636
(APH) 		12 MET A 103
ILE A 105
ASP A 200
TYR A 202
VAL A 203
ALA A 234
MET A 237
VAL A 238
GLY A 273
THR A 276
PHE A 280
TYR A 289
 ERY  A 402 (-2.2A)
ERY  A 402 ( 4.4A)
ERY  A 402 (-2.4A)
ERY  A 402 (-2.7A)
None
ERY  A 402 ( 3.2A)
ERY  A 402 ( 3.0A)
ERY  A 402 ( 4.7A)
ERY  A 402 ( 3.6A)
ERY  A 402 ( 3.8A)
ERY  A 402 ( 3.6A)
None
 0.48A 5igiA-5igpA:
47.5		 5igiA-5igpA:
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.
5ihs ENDOGLUCANASE,
GLYCOSIDE HYDROLASE
FAMILY 5 PROTEIN

(Cytophaga
hutchinsonii) 		PF00150
(Cellulase) 		5 MET A  91
ASP A 122
GLY A 193
THR A 217
TYR A 221
 None
 1.05A 5igiA-5ihsA:
undetectable		 5igiA-5ihsA:
22.92
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.
5iv9 LPS-ASSEMBLY
LIPOPROTEIN LPTE
LPS-ASSEMBLY PROTEIN
LPTD

(Klebsiella
pneumoniae) 		PF03968
(OstA)
PF04390
(LptE)
PF04453
(OstA_C) 		5 MET B 147
ILE B 143
ASP A 584
VAL B 122
GLY A 613
 None
 1.25A 5igiA-5iv9B:
undetectable		 5igiA-5iv9B:
21.43
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.
5jvk UNCHARACTERIZED
PROTEIN

(Bacteroides
cellulosilyticus) 		no annotation 5 MET A 181
VAL A 185
VAL A 241
GLY A 398
TYR A 402
 None
None
None
None
GOL  A 654 (-4.4A)
 1.24A 5igiA-5jvkA:
undetectable		 5igiA-5jvkA:
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.
5m10 CYCLOHEXANONE
MONOOXYGENASE FROM
THERMOCRISPUM
MUNICIPALE

(Thermocrispum
municipale) 		PF07992
(Pyr_redox_2) 		5 ALA A 142
VAL A  13
GLY A  46
THR A  47
TYR A  92
 None
None
FAD  A 601 (-3.1A)
FAD  A 601 (-3.2A)
None
 1.11A 5igiA-5m10A:
undetectable		 5igiA-5m10A:
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.
5mg3 PROTEIN TRANSLOCASE
SUBUNIT SECD
PROTEIN TRANSLOCASE
SUBUNIT SECF

(Escherichia
coli) 		PF02355
(SecD_SecF)
PF07549
(Sec_GG)
PF13721
(SecD-TM1) 		5 ILE D 450
ASP F  51
ALA F 201
GLY D 571
THR D 572
 None
 1.12A 5igiA-5mg3D:
0.3		 5igiA-5mg3D:
20.03
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.
5ndl CRH-LIKE PROTEIN

(Aspergillus
fumigatus) 		no annotation 5 ILE A 110
VAL A 120
VAL A 172
PHE A  87
TYR A  43
 None
 1.27A 5igiA-5ndlA:
undetectable		 5igiA-5ndlA:
16.25
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.
5nue MALATE DEHYDROGENASE
1, CYTOPLASMIC

(Arabidopsis
thaliana) 		no annotation 5 ILE A  59
VAL A  54
ALA A  13
VAL A  22
GLY A  78
 None
 1.21A 5igiA-5nueA:
undetectable		 5igiA-5nueA:
14.29
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.
5o5j 30S RIBOSOMAL
PROTEIN S2

(Mycolicibacterium
smegmatis) 		PF00318
(Ribosomal_S2) 		5 ILE V 200
VAL V  57
ALA V 160
VAL V  67
GLY V 180
 None
 1.26A 5igiA-5o5jV:
1.4		 5igiA-5o5jV:
21.54
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.
5uco 2,4,6-TRIHYDROXYBENZ
OPHENONE SYNTHASE

(Hypericum
androsaemum) 		no annotation 5 ILE A 313
VAL A 383
ALA A 385
VAL A 286
GLY A 372
 None
 1.25A 5igiA-5ucoA:
undetectable		 5igiA-5ucoA:
10.30
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.
5uco 2,4,6-TRIHYDROXYBENZ
OPHENONE SYNTHASE

(Hypericum
androsaemum) 		no annotation 5 ILE A 313
VAL A 383
MET A 287
VAL A 286
GLY A 372
 None
 1.10A 5igiA-5ucoA:
undetectable		 5igiA-5ucoA:
10.30
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.
5uq6 TARTRATE-RESISTANT
ACID PHOSPHATASE
TYPE 5

(Sus scrofa) 		PF00149
(Metallophos) 		5 ILE A 133
VAL A 276
ALA A 274
VAL A 237
GLY A 242
 None
 1.19A 5igiA-5uq6A:
undetectable		 5igiA-5uq6A:
22.44
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.
5v2i GLYCOSYLASPARAGINASE

(Elizabethkingia
meningoseptica) 		PF01112
(Asparaginase_2) 		5 VAL A  91
ALA A  67
VAL A  79
GLY A 190
THR A 201
 None
 1.15A 5igiA-5v2iA:
undetectable		 5igiA-5v2iA:
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.
5vmm IRON-REGULATED CELL
WALL-ANCHORED
PROTEIN

(Staphylococcus
aureus) 		no annotation 5 MET H 254
VAL H 234
VAL H 200
THR H 179
PHE H 178
 None
 1.26A 5igiA-5vmmH:
undetectable		 5igiA-5vmmH:
18.63
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.
5wgc DAUNORUBICIN-DOXORUB
ICIN POLYKETIDE
SYNTHASE

(Streptomyces
peucetius) 		no annotation 5 ASP A 302
VAL A 164
ALA A 166
GLY A 146
THR A 145
 None
 1.12A 5igiA-5wgcA:
undetectable		 5igiA-5wgcA:
15.23
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.
5yj6 DOCKERIN TYPE I
REPEAT-CONTAINING
PROTEIN

(Ruminiclostridium
thermocellum) 		no annotation 5 VAL A 264
ALA A  97
VAL A  93
GLY A 655
THR A 659
 None
 1.20A 5igiA-5yj6A:
undetectable		 5igiA-5yj6A:
14.29
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.
6ch3 FLAGELLAR
BIOSYNTHESIS PROTEIN
FLHA

(Salmonella
enterica) 		no annotation 5 ILE A 420
VAL A 367
MET A 374
VAL A 375
GLY A 435
 None
 1.18A 5igiA-6ch3A:
undetectable		 5igiA-6ch3A:
18.63
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.
6dzs HOMOSERINE
DEHYDROGENASE

(Mycolicibacterium
hassiacum) 		no annotation 5 MET A 318
ILE A  26
ALA A 105
VAL A 103
GLY A  83
 None
None
NAP  A 500 (-3.3A)
None
NAP  A 500 ( 3.2A)
 1.13A 5igiA-6dzsA:
undetectable		 5igiA-6dzsA:
undetectable