SIMILAR PATTERNS OF AMINO ACIDS FOR 4MME_B_29QB603

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.
1a5l UREASE (ALPHA
SUBUNIT)

(Klebsiella
aerogenes) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		5 VAL C 421
ALA C 418
GLY C 192
PHE C 491
GLY C 416
 None
 1.01A 4mmeB-1a5lC:
0.0		 4mmeB-1a5lC:
22.48
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.
1bev BOVINE ENTEROVIRUS
COAT PROTEINS VP1 TO
VP4

(Enterovirus E) 		PF00073
(Rhv) 		5 ALA 1 254
GLY 3  63
PHE 2 156
SER 1 268
GLY 1 266
 None
 1.03A 4mmeB-1bev1:
undetectable		 4mmeB-1bev1:
18.58
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.
1biy LACTOFERRIN

(Bubalus bubalis) 		PF00405
(Transferrin) 		5 VAL A 540
ALA A 541
GLY A 453
SER A 490
GLY A 538
 None
 1.16A 4mmeB-1biyA:
0.0		 4mmeB-1biyA:
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.
1cp9 PENICILLIN G AMIDASE

(Providencia
rettgeri) 		PF01804
(Penicil_amidase) 		5 ASP A  36
VAL B 499
ALA B 500
GLY A  13
SER B 504
 None
 1.29A 4mmeB-1cp9A:
undetectable		 4mmeB-1cp9A:
17.27
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1dbi AK.1 SERINE PROTEASE

(Bacillus sp.
Ak1) 		PF00082
(Peptidase_S8) 		5 ASP A  48
VAL A 211
ALA A 220
TYR A 219
GLY A  92
 CA  A 701 (-2.2A)
None
None
None
None
 1.01A 4mmeB-1dbiA:
undetectable		 4mmeB-1dbiA:
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.
1e3j NADP(H)-DEPENDENT
KETOSE REDUCTASE

(Bemisia
argentifolii) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 VAL A 219
ALA A 199
GLY A 257
SER A 248
GLY A 176
 None
PO4  A 903 (-3.4A)
None
None
PO4  A 903 ( 3.9A)
 1.20A 4mmeB-1e3jA:
0.0		 4mmeB-1e3jA:
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.
1ewk METABOTROPIC
GLUTAMATE RECEPTOR
SUBTYPE 1

(Rattus
norvegicus) 		PF01094
(ANF_receptor) 		5 ASP A 407
ALA A 184
GLY A  75
PHE A  51
GLY A 163
 None
 1.18A 4mmeB-1ewkA:
0.0		 4mmeB-1ewkA:
19.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1fi8 ECOTIN
NATURAL KILLER CELL
PROTEASE 1

(Escherichia
coli;
Rattus
norvegicus) 		PF00089
(Trypsin)
PF03974
(Ecotin) 		5 ASP C  84
VAL A 138
GLY A 142
SER A 195
GLY A 197
 None
 1.11A 4mmeB-1fi8C:
undetectable		 4mmeB-1fi8C:
10.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1i36 CONSERVED
HYPOTHETICAL PROTEIN
MTH1747

(Methanothermobacter
thermautotrophicus) 		PF03807
(F420_oxidored)
PF09130
(DUF1932) 		5 ASP A  86
VAL A  11
ALA A  12
SER A  62
GLY A   7
 None
NAP  A1350 (-3.8A)
None
None
NAP  A1350 (-3.4A)
 1.14A 4mmeB-1i36A:
undetectable		 4mmeB-1i36A:
20.20
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.
1jkm BREFELDIN A ESTERASE

(Bacillus
subtilis) 		PF07859
(Abhydrolase_3) 		5 VAL A 269
ALA A 266
TYR A 238
GLY A 127
GLY A 264
 None
 1.35A 4mmeB-1jkmA:
0.0		 4mmeB-1jkmA:
22.18
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.
1m1j FIBRINOGEN BETA
CHAIN

(Gallus gallus) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		5 ASP B 246
VAL B 243
TYR B 244
GLY B 253
SER B 227
 None
 1.22A 4mmeB-1m1jB:
undetectable		 4mmeB-1m1jB:
19.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n76 LACTOFERRIN

(Homo sapiens) 		PF00405
(Transferrin) 		5 VAL A 542
ALA A 543
GLY A 455
SER A 492
GLY A 540
 None
 1.26A 4mmeB-1n76A:
undetectable		 4mmeB-1n76A:
21.21
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.
1prn PORIN

(Rhodobacter
blasticus) 		PF13609
(Porin_4) 		5 TYR A 240
VAL A 280
ALA A 281
GLY A 108
PHE A 107
 None
None
C8E  A 901 (-3.6A)
None
None
 1.31A 4mmeB-1prnA:
undetectable		 4mmeB-1prnA:
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.
1sy7 CATALASE 1

(Neurospora
crassa) 		PF00199
(Catalase)
PF01965
(DJ-1_PfpI)
PF06628
(Catalase-rel) 		5 VAL A 671
TYR A 683
GLY A 647
PHE A 646
GLY A 684
 None
 1.33A 4mmeB-1sy7A:
undetectable		 4mmeB-1sy7A:
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.
1tki TITIN

(Homo sapiens) 		PF00069
(Pkinase) 		5 ASP A 144
VAL A 191
ALA A 188
TYR A 187
GLY A 141
 None
 1.29A 4mmeB-1tkiA:
undetectable		 4mmeB-1tkiA:
19.43
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.
1to6 GLYCERATE KINASE

(Neisseria
meningitidis) 		PF02595
(Gly_kinase) 		5 ASP A 264
VAL A  41
GLY A 296
SER A 261
GLY A  44
 None
 1.35A 4mmeB-1to6A:
undetectable		 4mmeB-1to6A:
22.70
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.
1u9c APC35852

(Geobacillus
stearothermophilus) 		PF01965
(DJ-1_PfpI) 		5 VAL A 192
GLY A 184
PHE A 190
SER A 151
GLY A 200
 None
 1.14A 4mmeB-1u9cA:
undetectable		 4mmeB-1u9cA:
18.87
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.
1uwi BETA-GALACTOSIDASE

(Sulfolobus
solfataricus) 		PF00232
(Glyco_hydro_1) 		5 VAL A 409
TYR A 422
GLY A 469
PHE A   4
GLY A 421
 None
 1.24A 4mmeB-1uwiA:
undetectable		 4mmeB-1uwiA:
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.
1vdk FUMARATE HYDRATASE
CLASS II

(Thermus
thermophilus) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 ASP A 142
VAL A 246
ALA A 247
GLY A 137
PHE A 242
 None
 1.18A 4mmeB-1vdkA:
undetectable		 4mmeB-1vdkA:
21.78
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.
1w0m TRIOSEPHOSPHATE
ISOMERASE

(Thermoproteus
tenax) 		PF00121
(TIM)
PF05690
(ThiG) 		5 VAL A  89
ALA A  61
TYR A  60
GLY A 114
GLY A  86
 None
 1.17A 4mmeB-1w0mA:
undetectable		 4mmeB-1w0mA:
19.47
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.
1wko TERMINAL FLOWER 1
PROTEIN

(Arabidopsis
thaliana) 		PF01161
(PBP) 		5 ASP A  23
VAL A 126
ALA A 163
GLY A 158
PHE A 128
 None
 1.14A 4mmeB-1wkoA:
undetectable		 4mmeB-1wkoA:
15.87
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.
1xje RIBONUCLEOTIDE
REDUCTASE,
B12-DEPENDENT

(Thermotoga
maritima) 		PF00317
(Ribonuc_red_lgN)
PF02867
(Ribonuc_red_lgC) 		5 ALA A 617
TYR A 614
GLY A 246
PHE A 247
GLY A 624
 None
 1.27A 4mmeB-1xjeA:
undetectable		 4mmeB-1xjeA:
22.82
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.
1xkq SHORT-CHAIN
REDUCTASE FAMILY
MEMBER (5D234)

(Caenorhabditis
elegans) 		PF13561
(adh_short_C2) 		5 ASP A 170
VAL A 257
ALA A 258
GLY A 152
SER A 147
 None
 1.33A 4mmeB-1xkqA:
undetectable		 4mmeB-1xkqA:
20.08
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.
1yew PARTICULATE METHANE
MONOOXYGENASE
SUBUNIT C2

(Methylococcus
capsulatus) 		PF04896
(AmoC) 		5 ALA C 144
TYR C 146
PHE C 152
SER C 150
GLY C 148
 None
 1.24A 4mmeB-1yewC:
0.7		 4mmeB-1yewC:
21.59
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.
2aj4 GALACTOKINASE

(Saccharomyces
cerevisiae) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		5 ASP A 217
VAL A 232
ALA A 240
GLY A 214
PHE A 234
 GLA  A 529 (-2.9A)
None
None
GLA  A 529 (-3.9A)
None
 1.11A 4mmeB-2aj4A:
undetectable		 4mmeB-2aj4A:
21.07
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.
2cdp BETA-AGARASE 1

(Saccharophagus
degradans) 		PF03422
(CBM_6) 		5 TYR A  63
VAL A 108
PHE A  76
SER A  62
GLY A 105
 None
CL  A1144 ( 4.2A)
None
None
EDO  A1141 (-4.0A)
 0.93A 4mmeB-2cdpA:
undetectable		 4mmeB-2cdpA:
14.20
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.
2cex PROTEIN HI0146

(Haemophilus
influenzae) 		PF03480
(DctP) 		5 VAL A  80
ALA A  79
GLY A 103
PHE A 102
SER A  68
 None
 1.23A 4mmeB-2cexA:
1.2		 4mmeB-2cexA:
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.
2cy8 D-PHENYLGLYCINE
AMINOTRANSFERASE

(Pseudomonas
stutzeri) 		PF00202
(Aminotran_3) 		5 ASP A 201
ALA A 231
GLY A 138
SER A 200
GLY A 235
 None
 1.13A 4mmeB-2cy8A:
undetectable		 4mmeB-2cy8A:
22.41
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.
2dne DIHYDROLIPOYLLYSINE-
RESIDUE
ACETYLTRANSFERASE
COMPONENT OF
PYRUVATE
DEHYDROGENASE
COMPLEX

(Homo sapiens) 		PF00364
(Biotin_lipoyl) 		5 ASP A  72
VAL A  66
ALA A  67
GLY A  22
GLY A  69
 None
 1.24A 4mmeB-2dneA:
undetectable		 4mmeB-2dneA:
11.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2epj GLUTAMATE-1-SEMIALDE
HYDE 2,1-AMINOMUTASE

(Aeropyrum
pernix) 		PF00202
(Aminotran_3) 		5 VAL A 268
ALA A 281
GLY A 150
SER A 120
GLY A 270
 None
None
PMP  A 501 ( 3.9A)
PMP  A 501 ( 3.8A)
None
 1.35A 4mmeB-2epjA:
undetectable		 4mmeB-2epjA:
24.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2nxo HYPOTHETICAL PROTEIN
SCO4506

(Streptomyces
coelicolor) 		PF02621
(VitK2_biosynth) 		5 VAL A 187
ALA A 186
GLY A 250
PHE A 249
GLY A  78
 None
 1.21A 4mmeB-2nxoA:
undetectable		 4mmeB-2nxoA:
18.93
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.
2o6l UDP-GLUCURONOSYLTRAN
SFERASE 2B7

(Homo sapiens) 		PF00201
(UDPGT) 		5 ASP A 435
VAL A 413
ALA A 412
SER A 437
GLY A 410
 None
 1.29A 4mmeB-2o6lA:
undetectable		 4mmeB-2o6lA:
14.65
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.
2qny 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 3

(Mycobacterium
tuberculosis) 		PF08541
(ACP_syn_III_C)
PF08545
(ACP_syn_III) 		5 VAL A 164
ALA A 163
GLY A 116
PHE A 115
GLY A 138
 None
 1.09A 4mmeB-2qnyA:
undetectable		 4mmeB-2qnyA:
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.
2w82 ORF18

(Enterococcus
faecalis) 		PF07275
(ArdA) 		5 VAL A 116
ALA A 117
GLY A 151
PHE A 153
GLY A 144
 None
 1.19A 4mmeB-2w82A:
undetectable		 4mmeB-2w82A:
13.98
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.
3aje PUTATIVE
UNCHARACTERIZED
PROTEIN ST1526

(Sulfurisphaera
tokodaii) 		PF01300
(Sua5_yciO_yrdC)
PF03481
(SUA5) 		5 VAL A 294
ALA A 295
GLY A 317
PHE A 318
GLY A 324
 None
 0.99A 4mmeB-3ajeA:
undetectable		 4mmeB-3ajeA:
21.52
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.
3bvh FIBRINOGEN BETA
CHAIN

(Homo sapiens) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha) 		5 ASP B 241
VAL B 238
TYR B 239
GLY B 248
SER B 222
 None
 1.22A 4mmeB-3bvhB:
undetectable		 4mmeB-3bvhB:
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.
3bw2 2-NITROPROPANE
DIOXYGENASE

(Streptomyces
ansochromogenes) 		PF03060
(NMO) 		5 VAL A  31
ALA A  30
GLY A 237
PHE A 240
SER A  23
 None
None
FMN  A 370 (-3.2A)
None
None
 0.93A 4mmeB-3bw2A:
undetectable		 4mmeB-3bw2A:
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.
3ctd PUTATIVE ATPASE, AAA
FAMILY

(Prochlorococcus
marinus) 		PF12002
(MgsA_C)
PF16193
(AAA_assoc_2) 		6 ASP A 311
VAL A 318
ALA A 340
TYR A 343
GLY A 308
SER A 347
 None
 1.40A 4mmeB-3ctdA:
undetectable		 4mmeB-3ctdA:
17.99
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.
3fa3 2,3-DIMETHYLMALATE
LYASE

(Aspergillus
niger) 		PF13714
(PEP_mutase) 		5 ASP A  87
VAL A 216
GLY A  49
PHE A 241
GLY A  25
 MN  A 401 ( 2.9A)
None
None
None
None
 1.32A 4mmeB-3fa3A:
undetectable		 4mmeB-3fa3A:
20.64
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.
3g1b ATP-DEPENDENT CLP
PROTEASE ADAPTER
PROTEIN CLPS

(Caulobacter
vibrioides) 		PF02617
(ClpS) 		5 TYR A  89
VAL A 101
ALA A  99
GLY A  87
PHE A  64
 None
 1.24A 4mmeB-3g1bA:
undetectable		 4mmeB-3g1bA:
7.63
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.
3hc1 UNCHARACTERIZED HDOD
DOMAIN PROTEIN

(Geobacter
sulfurreducens) 		PF08668
(HDOD) 		5 ASP A 152
ALA A 129
GLY A 246
SER A 122
GLY A 124
 FE  A 306 ( 2.5A)
None
None
None
None
 1.16A 4mmeB-3hc1A:
undetectable		 4mmeB-3hc1A:
23.47
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.
3hgq HDA1 COMPLEX SUBUNIT
3

(Saccharomyces
cerevisiae) 		PF11496
(HDA2-3) 		5 ASP A 245
VAL A 266
ALA A 269
GLY A  81
SER A 243
 None
 1.30A 4mmeB-3hgqA:
undetectable		 4mmeB-3hgqA:
21.78
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.
3kd6 CARBOHYDRATE KINASE,
PFKB FAMILY

(Chlorobaculum
tepidum) 		PF00294
(PfkB) 		5 VAL A 262
ALA A 261
GLY A 236
PHE A 239
GLY A 242
 None
None
GOL  A 501 ( 3.2A)
None
None
 1.26A 4mmeB-3kd6A:
undetectable		 4mmeB-3kd6A:
21.61
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.
3llm ATP-DEPENDENT RNA
HELICASE A

(Homo sapiens) 		PF00270
(DEAD) 		5 VAL A 457
ALA A 458
PHE A 488
SER A 485
GLY A 470
 None
 1.30A 4mmeB-3llmA:
undetectable		 4mmeB-3llmA:
19.04
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.
3mdn GLUTAMINE
AMINOTRANSFERASE
CLASS-II DOMAIN
PROTEIN

(Ruegeria
pomeroyi) 		PF13230
(GATase_4) 		5 ASP A  50
VAL A  73
ALA A  74
GLY A  56
SER A  79
 None
 1.25A 4mmeB-3mdnA:
undetectable		 4mmeB-3mdnA:
18.85
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 VAL A 104
ALA A 105
TYR A 108
PHE A 259
SER A 355
 None
None
LEU  A 601 (-4.5A)
LEU  A 601 (-3.6A)
NA  A 751 ( 2.3A)
 0.41A 4mmeB-3mpnA:
61.0		 4mmeB-3mpnA:
98.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3qlb ENANTIO-PYOCHELIN
RECEPTOR

(Pseudomonas
fluorescens) 		PF00593
(TonB_dep_Rec)
PF07715
(Plug) 		5 ASP A 341
TYR A 415
GLY A 110
PHE A 141
GLY A 142
 None
 1.22A 4mmeB-3qlbA:
undetectable		 4mmeB-3qlbA:
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.
3sjn MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Shewanella
pealeana) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ASP A 178
VAL A 185
ALA A 184
GLY A 167
PHE A 166
 None
 1.29A 4mmeB-3sjnA:
undetectable		 4mmeB-3sjnA:
20.91
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.
3tv2 FUMARATE HYDRATASE,
CLASS II

(Burkholderia
pseudomallei) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 ASP A 282
VAL A 386
ALA A 384
GLY A 277
PHE A 382
 None
 1.26A 4mmeB-3tv2A:
undetectable		 4mmeB-3tv2A:
23.13
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.
3tv2 FUMARATE HYDRATASE,
CLASS II

(Burkholderia
pseudomallei) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		5 ASP A 282
VAL A 386
ALA A 387
GLY A 277
PHE A 382
 None
 1.34A 4mmeB-3tv2A:
undetectable		 4mmeB-3tv2A:
23.13
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.
3wyw GLUTATHIONE
S-TRANSFERASE

(Nilaparvata
lugens) 		PF00043
(GST_C)
PF13417
(GST_N_3) 		5 TYR A 107
VAL A 171
ALA A 170
GLY A 111
SER A 164
 None
 1.20A 4mmeB-3wywA:
undetectable		 4mmeB-3wywA:
19.00
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.
3zlb PHOSPHOGLYCERATE
KINASE

(Streptococcus
pneumoniae) 		PF00162
(PGK) 		5 VAL A 290
ALA A 289
TYR A 233
GLY A 300
GLY A 287
 None
None
None
None
MG  A1400 ( 4.3A)
 1.14A 4mmeB-3zlbA:
undetectable		 4mmeB-3zlbA:
24.59
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.
3zuk ENDOPEPTIDASE,
PEPTIDASE FAMILY M13

(Mycobacterium
tuberculosis) 		PF01431
(Peptidase_M13)
PF05649
(Peptidase_M13_N) 		5 VAL A 596
ALA A 482
TYR A 484
GLY A 567
GLY A 486
 None
 1.14A 4mmeB-3zukA:
2.2		 4mmeB-3zukA:
21.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4au0 EXOGLUCANASE 2

(Trichoderma
reesei) 		PF01341
(Glyco_hydro_6) 		5 VAL A 127
ALA A 126
GLY A 374
PHE A 375
SER A 445
 None
 1.22A 4mmeB-4au0A:
undetectable		 4mmeB-4au0A:
22.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4e2o ALPHA-AMYLASE

(Geobacillus
thermoleovorans) 		PF00128
(Alpha-amylase) 		5 ASP A 113
VAL A  57
TYR A  65
GLY A 117
GLY A  68
 None
 1.32A 4mmeB-4e2oA:
undetectable		 4mmeB-4e2oA:
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.
4e4g METHYLMALONATE-SEMIA
LDEHYDE
DEHYDROGENASE

(Sinorhizobium
meliloti) 		PF00171
(Aldedh) 		5 ASP A 465
ALA A 242
GLY A 449
PHE A 245
GLY A 457
 None
 1.30A 4mmeB-4e4gA:
undetectable		 4mmeB-4e4gA:
23.54
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.
4egv ACETYL-COA
ACETYLTRANSFERASE

(Mycolicibacterium
smegmatis) 		no annotation 5 ASP A 328
ALA A 260
GLY A 359
PHE A 363
SER A 371
 None
 1.34A 4mmeB-4egvA:
0.1		 4mmeB-4egvA:
23.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ex4 MALATE SYNTHASE G

(Mycobacterium
leprae) 		PF01274
(Malate_synthase) 		5 ASP A 456
VAL A 459
ALA A 514
GLY A 430
SER A 101
 None
 1.31A 4mmeB-4ex4A:
undetectable		 4mmeB-4ex4A:
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.
4ezb UNCHARACTERIZED
CONSERVED PROTEIN

(Sinorhizobium
meliloti) 		PF03807
(F420_oxidored)
PF09130
(DUF1932) 		5 ASP A  96
ALA A  13
GLY A  74
SER A  70
GLY A   8
 None
 1.20A 4mmeB-4ezbA:
undetectable		 4mmeB-4ezbA:
22.09
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.
4fbo PSEUDOMONAS
FLUORESCENS
AGGLUTININ

(Pseudomonas
fluorescens) 		no annotation 5 VAL A   6
ALA A   5
TYR A   4
GLY A 116
PHE A 128
 None
 1.33A 4mmeB-4fboA:
undetectable		 4mmeB-4fboA:
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.
4i2o FIXK2 PROTEIN

(Bradyrhizobium
japonicum) 		PF00027
(cNMP_binding)
PF13545
(HTH_Crp_2) 		5 TYR A  52
ALA A 106
TYR A  45
GLY A  93
PHE A  92
 None
 1.13A 4mmeB-4i2oA:
undetectable		 4mmeB-4i2oA:
18.65
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.
4iql ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
II

(Porphyromonas
gingivalis) 		PF03060
(NMO) 		5 VAL A  31
ALA A  30
GLY A 192
PHE A 195
SER A  23
 None
None
FMN  A 401 (-3.4A)
None
None
 1.00A 4mmeB-4iqlA:
undetectable		 4mmeB-4iqlA:
21.83
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.
4ke4 HYDROXYCINNAMOYL-COA
:SHIKIMATE
HYDROXYCINNAMOYL
TRANSFERASE

(Sorghum bicolor) 		PF02458
(Transferase) 		5 TYR A 411
ALA A 415
GLY A 372
PHE A 376
GLY A 413
 PG4  A 501 ( 4.7A)
None
None
None
None
 1.28A 4mmeB-4ke4A:
undetectable		 4mmeB-4ke4A:
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.
4kh3 ANTIGEN 43

(Escherichia
coli) 		PF16168
(AIDA) 		5 ASP A 339
VAL A 344
GLY A 322
SER A 340
GLY A 357
 None
 1.26A 4mmeB-4kh3A:
undetectable		 4mmeB-4kh3A:
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.
4nml RIBULOSE 5-PHOSPHATE
ISOMERASE

(Toxoplasma
gondii) 		PF06026
(Rib_5-P_isom_A) 		5 ASP A  91
ALA A 239
GLY A 233
PHE A 235
GLY A  99
 MLT  A 303 (-4.5A)
None
None
None
None
 1.21A 4mmeB-4nmlA:
undetectable		 4mmeB-4nmlA:
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.
4nn0 COMPLEMENT C1Q TUMOR
NECROSIS
FACTOR-RELATED
PROTEIN 5

(Homo sapiens) 		PF00386
(C1q) 		5 TYR A 136
VAL A 155
ALA A 154
GLY A 141
PHE A 125
 None
 1.19A 4mmeB-4nn0A:
undetectable		 4mmeB-4nn0A:
13.81
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.
4ohn ABC TRANSPORTER
SUBSTRATE-BINDING
PROTEIN

(Streptococcus
pneumoniae) 		PF00497
(SBP_bac_3) 		5 ALA A  62
TYR A  61
GLY A  44
SER A  47
GLY A  53
 None
 0.97A 4mmeB-4ohnA:
undetectable		 4mmeB-4ohnA:
20.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4pag PERIPLASMIC BINDING
PROTEIN

(Sulfurospirillum
deleyianum) 		PF01497
(Peripla_BP_2) 		5 ASP A 286
ALA A 192
TYR A 191
GLY A 229
GLY A 194
 None
 1.31A 4mmeB-4pagA:
undetectable		 4mmeB-4pagA:
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.
4pel PENICILLIN G ACYLASE
SUBUNIT ALPHA
PENICILLIN G ACYLASE
SUBUNIT BETA

(Kluyvera
cryocrescens) 		PF01804
(Penicil_amidase) 		5 ASP A  38
VAL B 503
ALA B 504
GLY A  15
SER B 508
 None
 1.32A 4mmeB-4pelA:
undetectable		 4mmeB-4pelA:
19.10
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.
4phz PARTICULATE METHANE
MONOOXYGENASE
SUBUNIT C

(Methylocystis
sp. ATCC 49242) 		no annotation 5 ALA K 117
TYR K 119
PHE K 125
SER K 123
GLY K 121
 None
 1.21A 4mmeB-4phzK:
0.8		 4mmeB-4phzK:
19.85
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.
4psp ALPHA-FUCOSIDASE
GH29

(Fusarium
graminearum) 		PF01120
(Alpha_L_fucos)
PF16757
(Fucosidase_C) 		5 ASP A 303
VAL A 167
ALA A 120
TYR A  32
GLY A  30
 GOL  A 622 (-2.6A)
None
None
None
None
 1.00A 4mmeB-4pspA:
undetectable		 4mmeB-4pspA:
23.29
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.
4qav 3-OXOACYL-[ACYL-CARR
IER-PROTEIN]
SYNTHASE 2

(Neisseria
meningitidis) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 VAL A 351
ALA A 350
TYR A 352
GLY A 236
GLY A 346
 None
 1.19A 4mmeB-4qavA:
undetectable		 4mmeB-4qavA:
23.80
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.
4rjw PORIN O

(Pseudomonas
aeruginosa) 		PF07396
(Porin_O_P) 		5 ASP A 116
VAL A 189
ALA A 162
TYR A 163
SER A 165
 None
 1.30A 4mmeB-4rjwA:
undetectable		 4mmeB-4rjwA:
22.74
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.
4uoo LIPOTEICHOIC ACID
SYNTHASE

(Listeria
monocytogenes) 		PF00884
(Sulfatase) 		5 TYR A 380
VAL A 351
ALA A 350
GLY A 354
SER A 401
 None
 1.26A 4mmeB-4uooA:
undetectable		 4mmeB-4uooA:
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.
4xn3 TAIL SPIKE PROTEIN

(Salmonella
virus HK620) 		no annotation 5 ASP A 561
VAL A 615
ALA A 614
GLY A 556
PHE A 584
 None
 1.17A 4mmeB-4xn3A:
undetectable		 4mmeB-4xn3A:
22.42
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.
4xnu INTEGRAL MEMBRANE
PROTEIN-DOPAMINE
TRANSPORTER

(Drosophila
melanogaster) 		PF00209
(SNF) 		6 ASP A  46
VAL A 120
TYR A 124
GLY A 322
SER A 421
GLY A 425
 41U  A 605 ( 3.3A)
41U  A 605 (-4.2A)
41U  A 605 ( 3.8A)
41U  A 605 ( 4.1A)
NA  A 602 ( 2.4A)
41U  A 605 ( 3.7A)
 0.56A 4mmeB-4xnuA:
40.8		 4mmeB-4xnuA:
29.56
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.
4ybn FLAVIN-NUCLEOTIDE-BI
NDING PROTEIN

(Mycolicibacterium
smegmatis) 		PF12900
(Pyridox_ox_2) 		5 ASP A  31
VAL A  84
ALA A 106
GLY A  54
PHE A  53
 None
 1.30A 4mmeB-4ybnA:
undetectable		 4mmeB-4ybnA:
19.43
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.
5b3h PROTEIN SCARECROW

(Arabidopsis
thaliana) 		PF03514
(GRAS) 		5 VAL A 517
ALA A 648
GLY A 599
PHE A 600
GLY A 602
 None
 1.27A 4mmeB-5b3hA:
undetectable		 4mmeB-5b3hA:
22.18
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.
5dud YBGK

(Escherichia
coli) 		PF02626
(CT_A_B) 		5 ASP A  15
VAL A 121
GLY A 126
SER A 129
GLY A 137
 None
 1.21A 4mmeB-5dudA:
undetectable		 4mmeB-5dudA:
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.
5epg ALDEHYDE OXIDASE

(Homo sapiens) 		PF00111
(Fer2)
PF00941
(FAD_binding_5)
PF01315
(Ald_Xan_dh_C)
PF01799
(Fer2_2)
PF02738
(Ald_Xan_dh_C2)
PF03450
(CO_deh_flav_C) 		5 ASP A1093
VAL A1163
TYR A1161
SER A1265
GLY A1192
 None
 1.03A 4mmeB-5epgA:
undetectable		 4mmeB-5epgA:
18.12
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.
5fse UREASE SUBUNIT ALPHA

(Sporosarcina
pasteurii) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		5 VAL C 424
ALA C 421
GLY C 195
PHE C 494
GLY C 419
 None
 1.04A 4mmeB-5fseC:
undetectable		 4mmeB-5fseC:
22.10
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.
5h82 HETEROYOHIMBINE
SYNTHASE THAS2

(Catharanthus
roseus) 		PF00107
(ADH_zinc_N)
PF08240
(ADH_N) 		5 ASP A 335
VAL A 211
ALA A 210
PHE A 203
GLY A 207
 None
 1.05A 4mmeB-5h82A:
undetectable		 4mmeB-5h82A:
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.
5ham RICKCE

(Rickettsia
bellii) 		no annotation 5 ASP A 624
GLY A 656
PHE A 631
SER A 626
GLY A 629
 None
 1.10A 4mmeB-5hamA:
undetectable		 4mmeB-5hamA:
20.38
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5i6z SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER

(Homo sapiens) 		PF00209
(SNF) 		6 TYR A  95
ASP A  98
ALA A 169
GLY A 338
SER A 438
GLY A 442
 None
 1.40A 4mmeB-5i6zA:
42.1		 4mmeB-5i6zA:
31.21
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5i6z SODIUM-DEPENDENT
SEROTONIN
TRANSPORTER

(Homo sapiens) 		PF00209
(SNF) 		7 TYR A  95
ASP A  98
ALA A 173
TYR A 176
GLY A 338
SER A 438
GLY A 442
 None
 0.71A 4mmeB-5i6zA:
42.1		 4mmeB-5i6zA:
31.21
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.
5iw7 RIBOSOME BIOGENESIS
PROTEIN
TSR1,RIBOSOME
BIOGENESIS PROTEIN
TSR1

(Saccharomyces
cerevisiae) 		PF04950
(RIBIOP_C)
PF08142
(AARP2CN) 		5 VAL A 769
ALA A 770
GLY A 761
PHE A 759
SER A 739
 None
 1.32A 4mmeB-5iw7A:
undetectable		 4mmeB-5iw7A:
22.55
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.
5jay 8-AMINO-7-OXONONANOA
TE SYNTHASE

(Paraburkholderia
xenovorans) 		PF00155
(Aminotran_1_2) 		5 ALA A 249
GLY A 222
PHE A 213
SER A 236
GLY A 238
 None
 1.26A 4mmeB-5jayA:
undetectable		 4mmeB-5jayA:
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.
5jrl DIPEPTIDYL
AMINOPEPTIDASES/ACYL
AMINOACYL-PEPTIDASES
-LIKE PROTEIN

(Sphingopyxis
alaskensis) 		PF00326
(Peptidase_S9) 		5 ASP A 691
VAL A 490
ALA A 456
TYR A 488
GLY A 554
 None
 1.24A 4mmeB-5jrlA:
undetectable		 4mmeB-5jrlA:
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.
5k1c WD REPEAT-CONTAINING
PROTEIN 20

(Homo sapiens) 		PF00400
(WD40) 		5 ASP C 382
VAL C 288
ALA C 298
GLY C 370
GLY C 300
 None
 1.33A 4mmeB-5k1cC:
undetectable		 4mmeB-5k1cC:
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.
5koi ENOYL-[ACYL-CARRIER-
PROTEIN] REDUCTASE
[NADH]

(Brucella
abortus) 		PF13561
(adh_short_C2) 		5 VAL A 185
ALA A 175
TYR A 178
GLY A 139
GLY A 179
 None
 1.30A 4mmeB-5koiA:
undetectable		 4mmeB-5koiA:
19.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m2n ELONGATOR COMPLEX
PROTEIN 2

(Saccharomyces
cerevisiae) 		PF00400
(WD40) 		5 ASP A 777
VAL A  51
GLY A  35
SER A 779
GLY A 383
 None
 1.25A 4mmeB-5m2nA:
undetectable		 4mmeB-5m2nA:
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.
5n4l CERULOPLASMIN

(Rattus
norvegicus) 		no annotation 5 ASP A 364
GLY A 369
PHE A 389
SER A 399
GLY A 397
 None
 1.28A 4mmeB-5n4lA:
undetectable		 4mmeB-5n4lA:
9.49
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.
5o5c PUTATIVE
DECARBOXYLASE
INVOLVED IN
DESFERRIOXAMINE
BIOSYNTHESIS

(Erwinia
amylovora) 		no annotation 5 VAL A 466
ALA A 465
PHE A 460
SER A  58
GLY A 463
 None
 1.28A 4mmeB-5o5cA:
undetectable		 4mmeB-5o5cA:
9.85
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.
5t8t S-ADENOSYLMETHIONINE
SYNTHASE

(Neisseria
gonorrhoeae) 		PF00438
(S-AdoMet_synt_N)
PF02772
(S-AdoMet_synt_M)
PF02773
(S-AdoMet_synt_C) 		5 ASP A 243
VAL A  11
ALA A 167
GLY A 245
GLY A  14
 None
 1.29A 4mmeB-5t8tA:
0.6		 4mmeB-5t8tA:
21.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tv7 PUTATIVE
PEPTIDOGLYCAN-BINDIN
G/HYDROLYSING
PROTEIN

(Clostridioides
difficile) 		PF01471
(PG_binding_1) 		5 VAL A 168
ALA A 167
GLY A 134
PHE A 160
SER A 162
 None
 0.95A 4mmeB-5tv7A:
undetectable		 4mmeB-5tv7A:
15.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5v57 SMOOTHENED
HOMOLOG,FLAVODOXIN,S
MOOTHENED HOMOLOG

(Desulfovibrio
vulgaris;
Homo sapiens) 		PF00258
(Flavodoxin_1)
PF01392
(Fz)
PF01534
(Frizzled) 		5 TYR A 394
ASP A 473
VAL A 404
PHE A 391
GLY A 393
 836  A1201 (-4.6A)
836  A1201 ( 4.9A)
None
836  A1201 (-3.5A)
None
 1.24A 4mmeB-5v57A:
undetectable		 4mmeB-5v57A:
22.50
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.
5wab PUTATIVE
BETA-GLUCOSIDASE

(Bifidobacterium
adolescentis) 		no annotation 5 VAL A 102
ALA A 103
GLY A  45
SER A 151
GLY A 149
 None
 1.30A 4mmeB-5wabA:
undetectable		 4mmeB-5wabA:
13.48
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.
5weo GLUTAMATE RECEPTOR
2,VOLTAGE-DEPENDENT
CALCIUM CHANNEL
GAMMA-2 SUBUNIT
CHIMERA

(Mus musculus;
Rattus
norvegicus) 		PF00060
(Lig_chan)
PF00822
(PMP22_Claudin)
PF01094
(ANF_receptor)
PF10613
(Lig_chan-Glu_bd) 		5 VAL A 530
ALA A 532
TYR A 533
SER A 537
GLY A 535
 None
 1.22A 4mmeB-5weoA:
undetectable		 4mmeB-5weoA:
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.
5zby HYDROGENASE
MATURATION PROTEASE
HYCI

(Thermococcus
kodakarensis) 		no annotation 5 VAL A  33
ALA A  34
GLY A 124
PHE A  29
GLY A  18
 None
 1.09A 4mmeB-5zbyA:
undetectable		 4mmeB-5zbyA:
11.36
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.
6f39 COMPLEMENT C1R
SUBCOMPONENT

(Homo sapiens) 		no annotation 5 ASP A 226
TYR A 197
GLY A 252
PHE A 223
SER A 278
 CA  A 303 (-3.2A)
None
None
None
CA  A 303 ( 3.8A)
 1.14A 4mmeB-6f39A:
undetectable		 4mmeB-6f39A:
9.43