SIMILAR PATTERNS OF AMINO ACIDS FOR 5VKQ_B_PCFB1804_0

List of similar pattern of amino acids derived from ASSAM search

Hit pattern: 3D amino acid arrangements similar to known drug binding site
Query pattern: Residues from known binding site for annotated drug that match the hit pattern

(Click link on the last column to view superposed patterns of amino acids in NGL viewer)
(Note that only 3-12 residue patterns can be used for ASSAM searches)
Filter list by:
Hit Macromolecule/
Organism		 Pfam Res. Interface HETATM RMSD Dali Z-score Seq. Identity (%) View Dock
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1a2z PYRROLIDONE CARBOXYL
PEPTIDASE

(Thermococcus
litoralis) 		PF01470
(Peptidase_C15) 		5 GLY A  39
LEU A   5
GLY A   8
LEU A  68
ILE A 121
 None
 1.10A 5vkqB-1a2zA:
0.0
5vkqC-1a2zA:
0.0		 5vkqB-1a2zA:
8.80
5vkqC-1a2zA:
8.80
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.
1a5l UREASE (ALPHA
SUBUNIT)

(Klebsiella
aerogenes) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		5 GLY C 212
VAL C 514
GLY C 195
LEU C 194
ILE C 131
 None
 1.24A 5vkqB-1a5lC:
2.2
5vkqC-1a5lC:
2.2		 5vkqB-1a5lC:
16.37
5vkqC-1a5lC:
16.37
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.
1al8 GLYCOLATE OXIDASE

(Spinacia
oleracea) 		PF01070
(FMN_dh) 		5 GLY A 286
VAL A 294
ILE A 307
GLY A 308
ILE A  64
 FMN  A 360 (-3.3A)
None
None
FMN  A 360 (-3.5A)
None
 0.98A 5vkqB-1al8A:
0.0
5vkqC-1al8A:
0.0		 5vkqB-1al8A:
11.41
5vkqC-1al8A:
11.41
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.
1al8 GLYCOLATE OXIDASE

(Spinacia
oleracea) 		PF01070
(FMN_dh) 		5 GLY A 286
VAL A 294
ILE A 307
GLY A 308
ILE A  69
 FMN  A 360 (-3.3A)
None
None
FMN  A 360 (-3.5A)
None
 1.14A 5vkqB-1al8A:
0.0
5vkqC-1al8A:
0.0		 5vkqB-1al8A:
11.41
5vkqC-1al8A:
11.41
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.
1al8 GLYCOLATE OXIDASE

(Spinacia
oleracea) 		PF01070
(FMN_dh) 		5 GLY A 287
VAL A 294
ILE A 307
GLY A 308
ILE A  64
 FMN  A 360 (-3.8A)
None
None
FMN  A 360 (-3.5A)
None
 1.09A 5vkqB-1al8A:
0.0
5vkqC-1al8A:
0.0		 5vkqB-1al8A:
11.41
5vkqC-1al8A:
11.41
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.
1aso ASCORBATE OXIDASE

(Cucurbita pepo) 		PF00394
(Cu-oxidase)
PF07731
(Cu-oxidase_2)
PF07732
(Cu-oxidase_3) 		5 GLY A 114
LEU A 115
ILE A  27
GLY A  33
ILE A  64
 None
 1.25A 5vkqB-1asoA:
undetectable
5vkqC-1asoA:
undetectable		 5vkqB-1asoA:
14.69
5vkqC-1asoA:
14.69
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.
1b24 PROTEIN (I-DMOI)

(Desulfurococcus
mucosus) 		PF14528
(LAGLIDADG_3) 		5 LEU A  95
ILE A  19
GLY A  16
LEU A 113
ILE A 151
 None
 0.87A 5vkqB-1b24A:
0.0
5vkqC-1b24A:
0.0		 5vkqB-1b24A:
7.51
5vkqC-1b24A:
7.51
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.
1dml DNA POLYMERASE
PROCESSIVITY FACTOR

(Human
alphaherpesvirus
1) 		PF02282
(Herpes_UL42) 		5 GLY A  42
LEU A  44
LEU A 108
VAL A 111
GLY A  37
 None
 1.13A 5vkqB-1dmlA:
0.0
5vkqC-1dmlA:
undetectable		 5vkqB-1dmlA:
12.05
5vkqC-1dmlA:
12.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e5m BETA KETOACYL ACYL
CARRIER PROTEIN
SYNTHASE II

(Synechocystis
sp. PCC 6803) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 155
LEU A 154
VAL A  82
ILE A 190
GLY A 105
 None
 1.11A 5vkqB-1e5mA:
0.0
5vkqC-1e5mA:
0.0		 5vkqB-1e5mA:
12.72
5vkqC-1e5mA:
12.72
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.
1ez4 LACTATE
DEHYDROGENASE

(Lactobacillus
pentosus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 GLY A 131
LEU A  25
VAL A  23
ILE A 262
GLY A 297
 None
 1.08A 5vkqB-1ez4A:
0.0
5vkqC-1ez4A:
0.0		 5vkqB-1ez4A:
10.91
5vkqC-1ez4A:
10.91
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.
1f3g GLUCOSE-SPECIFIC
PHOSPHOCARRIER
PROTEIN IIAGLC

(Escherichia
coli) 		PF00358
(PTS_EIIA_1) 		5 GLY A  28
LEU A  87
VAL A 138
ILE A  30
GLY A 154
 None
 1.22A 5vkqB-1f3gA:
undetectable
5vkqC-1f3gA:
undetectable		 5vkqB-1f3gA:
7.58
5vkqC-1f3gA:
7.58
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.
1f3o HYPOTHETICAL ABC
TRANSPORTER
ATP-BINDING PROTEIN
MJ0796

(Methanocaldococcus
jannaschii) 		PF00005
(ABC_tran) 		5 GLY A 174
LEU A 168
VAL A  88
ILE A 184
GLY A 181
 None
 1.05A 5vkqB-1f3oA:
0.0
5vkqC-1f3oA:
0.0		 5vkqB-1f3oA:
8.95
5vkqC-1f3oA:
8.95
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.
1fpz CYCLIN-DEPENDENT
KINASE INHIBITOR 3

(Homo sapiens) 		PF05706
(CDKN3) 		5 LEU A 126
ILE A 138
GLY A  44
LEU A  45
ILE A 180
 None
 1.14A 5vkqB-1fpzA:
0.0
5vkqC-1fpzA:
0.0		 5vkqB-1fpzA:
8.60
5vkqC-1fpzA:
8.60
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.
1fsu N-ACETYLGALACTOSAMIN
E-4-SULFATASE

(Homo sapiens) 		PF00884
(Sulfatase) 		5 GLY A  79
LEU A 337
VAL A 294
ILE A 380
LEU A  82
 None
 1.12A 5vkqB-1fsuA:
undetectable
5vkqC-1fsuA:
undetectable		 5vkqB-1fsuA:
15.08
5vkqC-1fsuA:
15.08
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.
1gec GLYCYL ENDOPEPTIDASE

(Carica papaya) 		PF00112
(Peptidase_C1) 		5 GLY E 119
LEU E 121
VAL E 206
ILE E 125
ILE E 148
 None
 1.09A 5vkqB-1gecE:
undetectable
5vkqC-1gecE:
undetectable		 5vkqB-1gecE:
7.92
5vkqC-1gecE:
7.92
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.
1gk2 HISTIDINE
AMMONIA-LYASE

(Pseudomonas
putida) 		PF00221
(Lyase_aromatic) 		5 LEU A 303
LEU A 293
GLY A 424
LEU A 427
ILE A 348
 None
 1.26A 5vkqB-1gk2A:
1.2
5vkqC-1gk2A:
1.2		 5vkqB-1gk2A:
15.46
5vkqC-1gk2A:
15.46
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.
1gnz GSI-B4 ISOLECTIN

(Griffonia
simplicifolia) 		PF00139
(Lectin_legB) 		5 LEU A  35
VAL A 228
ILE A 216
GLY A 215
ILE A 145
 None
 1.22A 5vkqB-1gnzA:
undetectable
5vkqC-1gnzA:
undetectable		 5vkqB-1gnzA:
9.98
5vkqC-1gnzA:
9.98
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.
1gq7 PROCLAVAMINATE
AMIDINO HYDROLASE

(Streptomyces
clavuligerus) 		PF00491
(Arginase) 		5 VAL A 238
ILE A 297
GLY A 298
LEU A 301
ILE A 221
 None
 0.89A 5vkqB-1gq7A:
undetectable
5vkqC-1gq7A:
undetectable		 5vkqB-1gq7A:
11.47
5vkqC-1gq7A:
11.47
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.
1gq8 PECTINESTERASE

(Daucus carota) 		PF01095
(Pectinesterase) 		5 GLY A 248
LEU A 223
VAL A 185
ILE A 240
GLY A 272
 None
 0.94A 5vkqB-1gq8A:
undetectable
5vkqC-1gq8A:
undetectable		 5vkqB-1gq8A:
11.65
5vkqC-1gq8A:
11.65
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.
1gy7 NUCLEAR TRANSPORT
FACTOR 2

(Saccharomyces
cerevisiae) 		PF02136
(NTF2) 		5 GLY A  28
VAL A 114
ILE A  50
LEU A  54
ILE A  84
 None
 1.02A 5vkqB-1gy7A:
undetectable
5vkqC-1gy7A:
undetectable		 5vkqB-1gy7A:
5.69
5vkqC-1gy7A:
5.69
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.
1gyt CYTOSOL
AMINOPEPTIDASE

(Escherichia
coli) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		5 GLY A 483
LEU A 406
ILE A 180
GLY A 183
ILE A 265
 None
 1.24A 5vkqB-1gytA:
undetectable
5vkqC-1gytA:
undetectable		 5vkqB-1gytA:
15.43
5vkqC-1gytA:
15.43
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.
1gz4 NAD-DEPENDENT MALIC
ENZYME

(Homo sapiens) 		PF00390
(malic)
PF03949
(Malic_M) 		5 GLY A 463
LEU A 292
GLY A 446
LEU A 419
ILE A 323
 None
 1.03A 5vkqB-1gz4A:
undetectable
5vkqC-1gz4A:
undetectable		 5vkqB-1gz4A:
14.80
5vkqC-1gz4A:
14.80
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.
1h54 MALTOSE
PHOSPHORYLASE

(Lactobacillus
brevis) 		PF03632
(Glyco_hydro_65m)
PF03633
(Glyco_hydro_65C)
PF03636
(Glyco_hydro_65N) 		5 LEU A  56
LEU A 148
VAL A 262
ILE A  54
GLY A  53
 None
 1.23A 5vkqB-1h54A:
3.4
5vkqC-1h54A:
3.4		 5vkqB-1h54A:
18.01
5vkqC-1h54A:
18.01
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.
1hyq CELL DIVISION
INHIBITOR (MIND-1)

(Archaeoglobus
fulgidus) 		PF01656
(CbiA) 		5 GLY A 166
LEU A 165
LEU A 116
ILE A 232
LEU A 228
 None
 1.24A 5vkqB-1hyqA:
undetectable
5vkqC-1hyqA:
undetectable		 5vkqB-1hyqA:
10.81
5vkqC-1hyqA:
10.81
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.
1i2m REGULATOR OF
CHROMOSOME
CONDENSATION 1

(Homo sapiens) 		PF00415
(RCC1) 		5 GLY B 393
LEU B 396
VAL B 415
GLY B 378
LEU B  40
 None
 1.09A 5vkqB-1i2mB:
undetectable
5vkqC-1i2mB:
undetectable		 5vkqB-1i2mB:
12.35
5vkqC-1i2mB:
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.
1i8d RIBOFLAVIN SYNTHASE

(Escherichia
coli) 		PF00677
(Lum_binding) 		5 GLY A  46
VAL A 180
ILE A 145
GLY A   4
ILE A 134
 None
 1.26A 5vkqB-1i8dA:
undetectable
5vkqC-1i8dA:
undetectable		 5vkqB-1i8dA:
8.97
5vkqC-1i8dA:
8.97
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.
1ih5 AQUAPORIN-1

(Homo sapiens) 		PF00230
(MIP) 		5 GLY A 145
LEU A 147
LEU A  81
ILE A 143
GLY A 140
 None
 1.23A 5vkqB-1ih5A:
undetectable
5vkqC-1ih5A:
undetectable		 5vkqB-1ih5A:
10.44
5vkqC-1ih5A:
10.44
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.
1iqp RFCS

(Pyrococcus
furiosus) 		PF00004
(AAA)
PF08542
(Rep_fac_C) 		5 LEU A 314
ILE A 324
GLY A 325
LEU A 247
ILE A 239
 None
 1.17A 5vkqB-1iqpA:
2.2
5vkqC-1iqpA:
2.2		 5vkqB-1iqpA:
11.72
5vkqC-1iqpA:
11.72
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.
1iu8 PYRROLIDONE-CARBOXYL
ATE PEPTIDASE

(Pyrococcus
horikoshii) 		PF01470
(Peptidase_C15) 		5 GLY A  35
LEU A   4
GLY A   7
LEU A  64
ILE A 117
 None
 1.11A 5vkqB-1iu8A:
undetectable
5vkqC-1iu8A:
undetectable		 5vkqB-1iu8A:
8.86
5vkqC-1iu8A:
8.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1j3n 3-OXOACYL-(ACYL-CARR
IER PROTEIN)
SYNTHASE II

(Thermus
thermophilus) 		PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C) 		5 GLY A 337
VAL A 346
ILE A  15
GLY A  32
ILE A  77
 None
 1.06A 5vkqB-1j3nA:
undetectable
5vkqC-1j3nA:
undetectable		 5vkqB-1j3nA:
14.50
5vkqC-1j3nA:
14.50
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.
1jke D-TYR-TRNATYR
DEACYLASE

(Escherichia
coli) 		PF02580
(Tyr_Deacylase) 		5 GLY A  51
LEU A  50
LEU A  28
VAL A  73
LEU A  45
 None
 1.26A 5vkqB-1jkeA:
undetectable
5vkqC-1jkeA:
undetectable		 5vkqB-1jkeA:
6.90
5vkqC-1jkeA:
6.90
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.
1jr6 HELICASE NS3

(Hepacivirus C) 		PF00271
(Helicase_C) 		5 LEU A  15
VAL A  13
ILE A  10
GLY A 123
ILE A  40
 None
 1.19A 5vkqB-1jr6A:
undetectable
5vkqC-1jr6A:
undetectable		 5vkqB-1jr6A:
6.66
5vkqC-1jr6A:
6.66
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.
1kpl PUTATIVE CLC FAMILY,
CHLORINE TRANSPORT
PROTEIN

(Salmonella
enterica) 		PF00654
(Voltage_CLC) 		5 GLY A 331
LEU A 332
ILE A 336
LEU A 366
ILE A 322
 None
 1.24A 5vkqB-1kplA:
undetectable
5vkqC-1kplA:
undetectable		 5vkqB-1kplA:
14.72
5vkqC-1kplA:
14.72
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.
1kt1 FK506-BINDING
PROTEIN FKBP51

(Saimiri
boliviensis) 		PF00254
(FKBP_C)
PF00515
(TPR_1)
PF13181
(TPR_8) 		5 GLY A 220
LEU A 219
ILE A 148
LEU A 143
ILE A 289
 None
 1.27A 5vkqB-1kt1A:
4.4
5vkqC-1kt1A:
4.4		 5vkqB-1kt1A:
14.60
5vkqC-1kt1A:
14.60
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.
1lml LEISHMANOLYSIN

(Leishmania
major) 		PF01457
(Peptidase_M8) 		5 GLY A 554
LEU A 543
VAL A 546
ILE A 556
GLY A 492
 None
 1.26A 5vkqB-1lmlA:
undetectable
5vkqC-1lmlA:
undetectable		 5vkqB-1lmlA:
14.02
5vkqC-1lmlA:
14.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lvl DIHYDROLIPOAMIDE
DEHYDROGENASE

(Pseudomonas
putida) 		PF02852
(Pyr_redox_dim)
PF07992
(Pyr_redox_2) 		5 LEU A 222
LEU A 214
VAL A 218
ILE A 188
GLY A 187
 None
 0.95A 5vkqB-1lvlA:
undetectable
5vkqC-1lvlA:
undetectable		 5vkqB-1lvlA:
13.86
5vkqC-1lvlA:
13.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lvw GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E

(Methanothermobacter
thermautotrophicus) 		PF00483
(NTP_transferase) 		5 GLY A 172
LEU A 106
LEU A  50
ILE A  86
ILE A  97
 None
TYD  A3001 (-3.4A)
None
None
None
 1.18A 5vkqB-1lvwA:
undetectable
5vkqC-1lvwA:
undetectable		 5vkqB-1lvwA:
9.76
5vkqC-1lvwA:
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.
1lvw GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E

(Methanothermobacter
thermautotrophicus) 		PF00483
(NTP_transferase) 		5 GLY A 172
LEU A 106
LEU A  50
ILE A 197
ILE A  97
 None
TYD  A3001 (-3.4A)
None
None
None
 1.21A 5vkqB-1lvwA:
undetectable
5vkqC-1lvwA:
undetectable		 5vkqB-1lvwA:
9.76
5vkqC-1lvwA:
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.
1mox EPIDERMAL GROWTH
FACTOR RECEPTOR

(Homo sapiens) 		PF00757
(Furin-like)
PF01030
(Recep_L_domain) 		5 GLY A 425
LEU A 424
LEU A 382
VAL A 416
ILE A 421
 CD  A 722 ( 4.5A)
None
None
None
None
 1.26A 5vkqB-1moxA:
undetectable
5vkqC-1moxA:
undetectable		 5vkqB-1moxA:
13.28
5vkqC-1moxA:
13.28
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.
1mp3 GLUCOSE-1-PHOSPHATE
THYMIDYLYLTRANSFERAS
E

(Salmonella
enterica) 		PF00483
(NTP_transferase) 		5 GLY A 175
LEU A 109
LEU A  53
ILE A 200
ILE A 100
 None
TTP  A 501 ( 3.9A)
None
None
None
 1.16A 5vkqB-1mp3A:
undetectable
5vkqC-1mp3A:
undetectable		 5vkqB-1mp3A:
10.67
5vkqC-1mp3A:
10.67
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.
1mzr 2,5-DIKETO-D-GLUCONA
TE REDUCTASE A

(Escherichia
coli) 		PF00248
(Aldo_ket_red) 		5 LEU A  10
ILE A 159
GLY A 137
LEU A 106
ILE A  46
 None
 1.17A 5vkqB-1mzrA:
undetectable
5vkqC-1mzrA:
undetectable		 5vkqB-1mzrA:
10.27
5vkqC-1mzrA:
10.27
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.
1mzr 2,5-DIKETO-D-GLUCONA
TE REDUCTASE A

(Escherichia
coli) 		PF00248
(Aldo_ket_red) 		5 LEU A  10
LEU A  19
ILE A 159
GLY A 137
LEU A 106
 None
 1.13A 5vkqB-1mzrA:
undetectable
5vkqC-1mzrA:
undetectable		 5vkqB-1mzrA:
10.27
5vkqC-1mzrA:
10.27
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.
1nmo HYPOTHETICAL PROTEIN
YBGI

(Escherichia
coli) 		PF01784
(NIF3) 		5 LEU A 236
VAL A 238
ILE A 223
GLY A 222
LEU A 100
 None
 1.20A 5vkqB-1nmoA:
undetectable
5vkqC-1nmoA:
undetectable		 5vkqB-1nmoA:
8.79
5vkqC-1nmoA:
8.79
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.
1nnt OVOTRANSFERRIN

(Gallus gallus) 		PF00405
(Transferrin) 		6 LEU A 267
LEU A  59
VAL A 252
ILE A   7
LEU A  34
ILE A  12
 None
 1.39A 5vkqB-1nntA:
undetectable
5vkqC-1nntA:
undetectable		 5vkqB-1nntA:
11.40
5vkqC-1nntA:
11.40
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.
1nvj MOLYBDOPTERIN
CONVERTING FACTOR
SUBUNIT 2

(Escherichia
coli) 		PF02391
(MoaE) 		5 GLY A  77
LEU A  76
LEU A  63
VAL A  67
ILE A  82
 GOL  A 141 ( 3.7A)
None
None
None
None
 1.26A 5vkqB-1nvjA:
undetectable
5vkqC-1nvjA:
undetectable		 5vkqB-1nvjA:
6.27
5vkqC-1nvjA:
6.27
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.
1oh9 ACETYLGLUTAMATE
KINASE

(Escherichia
coli) 		PF00696
(AA_kinase) 		5 LEU A 168
LEU A   9
VAL A  41
ILE A 133
LEU A 137
 None
 1.17A 5vkqB-1oh9A:
undetectable
5vkqC-1oh9A:
undetectable		 5vkqB-1oh9A:
10.19
5vkqC-1oh9A:
10.19
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.
1oht CG14704 PROTEIN

(Drosophila
melanogaster) 		PF01510
(Amidase_2) 		5 GLY A 162
LEU A 165
ILE A  41
GLY A 151
ILE A  76
 None
 1.01A 5vkqB-1ohtA:
undetectable
5vkqC-1ohtA:
undetectable		 5vkqB-1ohtA:
8.46
5vkqC-1ohtA:
8.46
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.
1ovm INDOLE-3-PYRUVATE
DECARBOXYLASE

(Enterobacter
cloacae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 GLY A 434
LEU A 542
VAL A 467
ILE A 410
GLY A 411
 TPP  A 600 (-3.2A)
None
TPP  A 600 (-3.4A)
TPP  A 600 (-4.0A)
None
 1.21A 5vkqB-1ovmA:
undetectable
5vkqC-1ovmA:
undetectable		 5vkqB-1ovmA:
15.67
5vkqC-1ovmA:
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.
1ovm INDOLE-3-PYRUVATE
DECARBOXYLASE

(Enterobacter
cloacae) 		PF00205
(TPP_enzyme_M)
PF02775
(TPP_enzyme_C)
PF02776
(TPP_enzyme_N) 		5 GLY A 446
LEU A 493
ILE A 442
LEU A 414
ILE A 526
 None
 0.81A 5vkqB-1ovmA:
undetectable
5vkqC-1ovmA:
undetectable		 5vkqB-1ovmA:
15.67
5vkqC-1ovmA:
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.
1p4a PUR OPERON REPRESSOR

(Bacillus
subtilis) 		PF00156
(Pribosyltran)
PF09182
(PuR_N) 		5 GLY A  88
LEU A  87
VAL A 118
ILE A 108
LEU A 105
 None
 1.15A 5vkqB-1p4aA:
3.5
5vkqC-1p4aA:
3.5		 5vkqB-1p4aA:
9.96
5vkqC-1p4aA:
9.96
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.
1p91 RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE A

(Escherichia
coli) 		PF13847
(Methyltransf_31) 		5 GLY A 114
LEU A  90
ILE A  92
GLY A  93
ILE A 262
 None
 1.13A 5vkqB-1p91A:
undetectable
5vkqC-1p91A:
undetectable		 5vkqB-1p91A:
9.44
5vkqC-1p91A:
9.44
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.
1p9b ADENYLOSUCCINATE
SYNTHETASE

(Plasmodium
falciparum) 		PF00709
(Adenylsucc_synt) 		5 LEU A 220
ILE A 262
GLY A 261
LEU A 260
ILE A  19
 None
 1.22A 5vkqB-1p9bA:
undetectable
5vkqC-1p9bA:
undetectable		 5vkqB-1p9bA:
13.95
5vkqC-1p9bA:
13.95
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.
1pie GALACTOKINASE

(Lactococcus
lactis) 		PF00288
(GHMP_kinases_N)
PF08544
(GHMP_kinases_C)
PF10509
(GalKase_gal_bdg) 		5 GLY A 121
LEU A  89
VAL A  92
ILE A 118
LEU A 150
 None
 1.25A 5vkqB-1pieA:
2.1
5vkqC-1pieA:
2.1		 5vkqB-1pieA:
12.75
5vkqC-1pieA:
12.75
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.
1prz RIBOSOMAL LARGE
SUBUNIT
PSEUDOURIDINE
SYNTHASE D

(Escherichia
coli) 		PF00849
(PseudoU_synth_2) 		5 GLY A 144
LEU A 138
LEU A 116
VAL A 104
ILE A 126
 None
 1.19A 5vkqB-1przA:
undetectable
5vkqC-1przA:
undetectable		 5vkqB-1przA:
9.08
5vkqC-1przA:
9.08
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.
1q3b ENDONUCLEASE VIII

(Escherichia
coli) 		PF01149
(Fapy_DNA_glyco)
PF06827
(zf-FPG_IleRS)
PF06831
(H2TH) 		5 GLY A  19
LEU A  55
VAL A  47
ILE A  17
LEU A  22
 None
 1.08A 5vkqB-1q3bA:
undetectable
5vkqC-1q3bA:
undetectable		 5vkqB-1q3bA:
10.37
5vkqC-1q3bA:
10.37
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.
1qax PROTEIN
(3-HYDROXY-3-METHYLG
LUTARYL-COENZYME A
REDUCTASE)

(Pseudomonas
mevalonii) 		PF00368
(HMG-CoA_red) 		5 GLY A  27
LEU A  28
LEU A 342
ILE A  22
ILE A 356
 None
 1.06A 5vkqB-1qaxA:
undetectable
5vkqC-1qaxA:
undetectable		 5vkqB-1qaxA:
13.64
5vkqC-1qaxA:
13.64
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.
1qup SUPEROXIDE DISMUTASE
1 COPPER CHAPERONE

(Saccharomyces
cerevisiae) 		PF00080
(Sod_Cu)
PF00403
(HMA) 		5 GLY A 102
LEU A 115
ILE A 157
GLY A 172
ILE A  58
 None
 1.12A 5vkqB-1qupA:
undetectable
5vkqC-1qupA:
undetectable		 5vkqB-1qupA:
11.13
5vkqC-1qupA:
11.13
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.
1r8g HYPOTHETICAL PROTEIN
YBDK

(Escherichia
coli) 		PF04107
(GCS2) 		5 LEU A 164
ILE A  16
GLY A  15
LEU A  14
ILE A 331
 None
 0.85A 5vkqB-1r8gA:
undetectable
5vkqC-1r8gA:
undetectable		 5vkqB-1r8gA:
13.06
5vkqC-1r8gA:
13.06
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.
1ro5 AUTOINDUCER
SYNTHESIS PROTEIN
LASI

(Pseudomonas
aeruginosa) 		PF00765
(Autoind_synth) 		5 GLY A   6
LEU A  22
ILE A  71
LEU A 128
ILE A 107
 None
 1.15A 5vkqB-1ro5A:
undetectable
5vkqC-1ro5A:
undetectable		 5vkqB-1ro5A:
7.69
5vkqC-1ro5A:
7.69
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.
1ryy ALPHA-AMINO ACID
ESTER HYDROLASE

(Acetobacter
pasteurianus) 		PF02129
(Peptidase_S15)
PF08530
(PepX_C) 		5 GLY A 335
LEU A 336
LEU A 599
ILE A 420
LEU A 363
 None
 1.20A 5vkqB-1ryyA:
undetectable
5vkqC-1ryyA:
undetectable		 5vkqB-1ryyA:
17.94
5vkqC-1ryyA:
17.94
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.
1s1f PUTATIVE CYTOCHROME
P450

(Streptomyces
coelicolor) 		PF00067
(p450) 		5 GLY A 355
LEU A 358
ILE A 157
GLY A 243
ILE A 203
 HEM  A 430 (-3.6A)
None
HG  A 436 (-4.7A)
HEM  A 430 (-3.3A)
None
 0.99A 5vkqB-1s1fA:
1.2
5vkqC-1s1fA:
undetectable		 5vkqB-1s1fA:
13.22
5vkqC-1s1fA:
13.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1sxj ACTIVATOR 1 40 KDA
SUBUNIT

(Saccharomyces
cerevisiae) 		PF00004
(AAA)
PF08542
(Rep_fac_C) 		5 LEU C 299
VAL C 282
ILE C 327
GLY C 325
ILE C 275
 None
 1.03A 5vkqB-1sxjC:
2.2
5vkqC-1sxjC:
2.2		 5vkqB-1sxjC:
12.00
5vkqC-1sxjC:
12.00
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.
1tdj BIOSYNTHETIC
THREONINE DEAMINASE

(Escherichia
coli) 		PF00291
(PALP)
PF00585
(Thr_dehydrat_C) 		5 GLY A 382
LEU A 341
VAL A 407
ILE A 395
LEU A 385
 None
 1.01A 5vkqB-1tdjA:
undetectable
5vkqC-1tdjA:
undetectable		 5vkqB-1tdjA:
15.54
5vkqC-1tdjA:
15.54
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.
1tj5 SUCROSE-PHOSPHATASE

(Synechocystis
sp. PCC 6803) 		PF05116
(S6PP) 		5 GLY A  68
LEU A  64
GLY A 164
LEU A 193
ILE A 233
 None
 1.18A 5vkqB-1tj5A:
undetectable
5vkqC-1tj5A:
undetectable		 5vkqB-1tj5A:
10.48
5vkqC-1tj5A:
10.48
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.
1tt4 PUTATIVE CYTOPLASMIC
PROTEIN

(Salmonella
enterica) 		PF04107
(GCS2) 		5 LEU A 164
ILE A  16
GLY A  15
LEU A  14
ILE A 331
 None
 0.83A 5vkqB-1tt4A:
undetectable
5vkqC-1tt4A:
undetectable		 5vkqB-1tt4A:
11.99
5vkqC-1tt4A:
11.99
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.
1u6z EXOPOLYPHOSPHATASE

(Escherichia
coli) 		PF02541
(Ppx-GppA) 		5 GLY A 274
LEU A 278
VAL A 281
ILE A 220
GLY A 218
 None
None
None
None
SO4  A 702 (-3.4A)
 1.13A 5vkqB-1u6zA:
undetectable
5vkqC-1u6zA:
undetectable		 5vkqB-1u6zA:
15.44
5vkqC-1u6zA:
15.44
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.
1ue0 ISOLEUCYL-TRNA
SYNTHETASE

(Thermus
thermophilus) 		PF00133
(tRNA-synt_1) 		5 GLY A 281
LEU A 284
LEU A 276
ILE A 317
GLY A 316
 None
 1.13A 5vkqB-1ue0A:
undetectable
5vkqC-1ue0A:
undetectable		 5vkqB-1ue0A:
7.40
5vkqC-1ue0A:
7.40
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.
1uer SUPEROXIDE DISMUTASE

(Porphyromonas
gingivalis) 		PF00081
(Sod_Fe_N)
PF02777
(Sod_Fe_C) 		5 GLY A  29
LEU A  32
ILE A   6
LEU A   8
ILE A 181
 None
 1.12A 5vkqB-1uerA:
undetectable
5vkqC-1uerA:
undetectable		 5vkqB-1uerA:
7.26
5vkqC-1uerA:
7.26
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.
1vkn N-ACETYL-GAMMA-GLUTA
MYL-PHOSPHATE
REDUCTASE

(Thermotoga
maritima) 		PF01118
(Semialdhyde_dh)
PF02774
(Semialdhyde_dhC) 		5 GLY A 215
LEU A 214
LEU A 162
ILE A 151
LEU A 129
 None
 1.25A 5vkqB-1vknA:
undetectable
5vkqC-1vknA:
undetectable		 5vkqB-1vknA:
11.71
5vkqC-1vknA:
11.71
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.
1w3i 2-KETO-3-DEOXY
GLUCONATE ALDOLASE

(Sulfolobus
solfataricus) 		PF00701
(DHDPS) 		5 LEU A  59
VAL A  62
ILE A  93
GLY A  95
ILE A  35
 None
 0.90A 5vkqB-1w3iA:
undetectable
5vkqC-1w3iA:
undetectable		 5vkqB-1w3iA:
11.71
5vkqC-1w3iA:
11.71
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.
1w55 ISPD/ISPF
BIFUNCTIONAL ENZYME

(Campylobacter
jejuni) 		PF01128
(IspD)
PF02542
(YgbB) 		5 GLY A 264
LEU A 258
LEU A 358
ILE A 266
GLY A 267
 None
None
None
None
C  A1372 (-3.1A)
 1.24A 5vkqB-1w55A:
undetectable
5vkqC-1w55A:
undetectable		 5vkqB-1w55A:
12.69
5vkqC-1w55A:
12.69
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.
1w5e FTSZ

(Methanocaldococcus
jannaschii) 		PF00091
(Tubulin)
PF12327
(FtsZ_C) 		5 GLY A 284
LEU A 311
VAL A 307
ILE A 279
ILE A 253
 None
 1.15A 5vkqB-1w5eA:
undetectable
5vkqC-1w5eA:
undetectable		 5vkqB-1w5eA:
13.58
5vkqC-1w5eA:
13.58
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.
1wpq GLYCEROL-3-PHOSPHATE
DEHYDROGENASE
[NAD+], CYTOPLASMIC

(Homo sapiens) 		PF01210
(NAD_Gly3P_dh_N)
PF07479
(NAD_Gly3P_dh_C) 		5 GLY A 107
LEU A 109
ILE A 142
GLY A 141
ILE A 119
 None
None
None
None
NAD  A3001 ( 4.4A)
 1.23A 5vkqB-1wpqA:
1.8
5vkqC-1wpqA:
1.8		 5vkqB-1wpqA:
12.84
5vkqC-1wpqA:
12.84
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.
1wwk PHOSPHOGLYCERATE
DEHYDROGENASE

(Pyrococcus
horikoshii) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 GLY A 252
LEU A 253
LEU A 210
VAL A 234
GLY A 250
 None
 1.01A 5vkqB-1wwkA:
undetectable
5vkqC-1wwkA:
undetectable		 5vkqB-1wwkA:
10.65
5vkqC-1wwkA:
10.65
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.
1xj5 SPERMIDINE SYNTHASE
1

(Arabidopsis
thaliana) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 LEU A 125
VAL A 221
ILE A 127
GLY A 128
ILE A 248
 None
 1.15A 5vkqB-1xj5A:
undetectable
5vkqC-1xj5A:
undetectable		 5vkqB-1xj5A:
10.67
5vkqC-1xj5A:
10.67
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.
1xm9 PLAKOPHILIN 1

(Homo sapiens) 		PF00514
(Arm) 		5 GLY A 549
LEU A 551
ILE A 579
GLY A 594
LEU A 582
 None
 1.14A 5vkqB-1xm9A:
3.6
5vkqC-1xm9A:
1.8		 5vkqB-1xm9A:
14.05
5vkqC-1xm9A:
14.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y0y FRV OPERON PROTEIN
FRVX

(Pyrococcus
horikoshii) 		PF05343
(Peptidase_M42) 		5 GLY A  28
LEU A  27
LEU A  74
VAL A 161
GLY A 110
 None
 1.20A 5vkqB-1y0yA:
undetectable
5vkqC-1y0yA:
undetectable		 5vkqB-1y0yA:
12.02
5vkqC-1y0yA:
12.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1y1u SIGNAL TRANSDUCER
AND ACTIVATOR OF
TRANSCRIPTION 5A

(Mus musculus) 		PF00017
(SH2)
PF01017
(STAT_alpha)
PF02864
(STAT_bind) 		5 GLY A 394
LEU A 464
VAL A 466
LEU A 397
ILE A 334
 None
 1.16A 5vkqB-1y1uA:
3.3
5vkqC-1y1uA:
3.4		 5vkqB-1y1uA:
15.62
5vkqC-1y1uA:
15.62
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.
1yx2 AMINOMETHYLTRANSFERA
SE

(Bacillus
subtilis) 		PF01571
(GCV_T)
PF08669
(GCV_T_C) 		5 LEU A 158
LEU A 143
ILE A 154
GLY A 215
LEU A 220
 None
 1.21A 5vkqB-1yx2A:
undetectable
5vkqC-1yx2A:
undetectable		 5vkqB-1yx2A:
12.20
5vkqC-1yx2A:
12.20
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.
1zkp HYPOTHETICAL PROTEIN
BA1088

(Bacillus
anthracis) 		PF12706
(Lactamase_B_2) 		5 GLY A  92
LEU A  57
LEU A  23
ILE A  90
GLY A 111
 None
 1.26A 5vkqB-1zkpA:
undetectable
5vkqC-1zkpA:
undetectable		 5vkqB-1zkpA:
9.26
5vkqC-1zkpA:
9.26
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.
1zsw GLYOXALASE FAMILY
PROTEIN

(Bacillus cereus) 		PF00903
(Glyoxalase) 		5 LEU A 125
LEU A  47
ILE A  81
GLY A  82
LEU A  83
 None
 1.26A 5vkqB-1zswA:
undetectable
5vkqC-1zswA:
undetectable		 5vkqB-1zswA:
10.55
5vkqC-1zswA:
10.55
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.
1zub REGULATING SYNAPTIC
MEMBRANE EXOCYTOSIS
PROTEIN 1

(Rattus
norvegicus) 		PF00595
(PDZ) 		5 GLY A 662
LEU A 664
GLY A 631
LEU A 630
ILE A 689
 None
 1.12A 5vkqB-1zubA:
undetectable
5vkqC-1zubA:
undetectable		 5vkqB-1zubA:
5.46
5vkqC-1zubA:
5.46
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.
1zub REGULATING SYNAPTIC
MEMBRANE EXOCYTOSIS
PROTEIN 1

(Rattus
norvegicus) 		PF00595
(PDZ) 		5 GLY A 662
LEU A 664
VAL A 670
GLY A 631
LEU A 630
 None
 1.08A 5vkqB-1zubA:
undetectable
5vkqC-1zubA:
undetectable		 5vkqB-1zubA:
5.46
5vkqC-1zubA:
5.46
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.
2aeh FOCAL ADHESION
KINASE 1

(Gallus gallus) 		PF00373
(FERM_M) 		5 LEU A 272
VAL A 329
ILE A 280
GLY A 279
ILE A 359
 None
 1.09A 5vkqB-2aehA:
undetectable
5vkqC-2aehA:
undetectable		 5vkqB-2aehA:
11.25
5vkqC-2aehA:
11.25
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.
2aj7 HYPOTHETICAL PROTEIN
BH3618

(Bacillus
halodurans) 		PF02623
(FliW) 		5 GLY A 123
LEU A  38
ILE A  26
GLY A  25
ILE A   4
 None
 1.04A 5vkqB-2aj7A:
undetectable
5vkqC-2aj7A:
undetectable		 5vkqB-2aj7A:
6.87
5vkqC-2aj7A:
6.87
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.
2aw5 NADP-DEPENDENT MALIC
ENZYME

(Homo sapiens) 		PF00390
(malic)
PF03949
(Malic_M) 		5 GLY A 450
LEU A 282
GLY A 433
LEU A 406
ILE A 313
 None
 0.99A 5vkqB-2aw5A:
2.2
5vkqC-2aw5A:
2.1		 5vkqB-2aw5A:
15.26
5vkqC-2aw5A:
15.26
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.
2bec CALCINEURIN B
HOMOLOGOUS PROTEIN 2
SODIUM/HYDROGEN
EXCHANGER 1

(Homo sapiens;
Homo sapiens) 		PF13202
(EF-hand_5)
PF13499
(EF-hand_7)
no annotation 		5 LEU B 530
LEU A 195
ILE A  66
GLY A  63
LEU A  57
 None
 1.09A 5vkqB-2becB:
undetectable
5vkqC-2becB:
undetectable		 5vkqB-2becB:
3.31
5vkqC-2becB:
3.31
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.
2bkx GLUCOSAMINE-6-PHOSPH
ATE DEAMINASE

(Bacillus
subtilis) 		PF01182
(Glucosamine_iso) 		5 GLY A 183
ILE A 139
GLY A 140
LEU A  66
ILE A 128
 None
None
F6R  A1243 (-3.0A)
F6R  A1243 (-4.0A)
None
 1.13A 5vkqB-2bkxA:
undetectable
5vkqC-2bkxA:
undetectable		 5vkqB-2bkxA:
9.78
5vkqC-2bkxA:
9.78
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.
2bl2 V-TYPE SODIUM ATP
SYNTHASE SUBUNIT K

(Enterococcus
hirae) 		PF00137
(ATP-synt_C) 		5 GLY A  66
LEU A  17
ILE A  28
GLY A  29
LEU A 104
 None
LHG  A1159 ( 4.6A)
LHG  A1158 ( 4.8A)
None
LHG  A1158 ( 4.8A)
 1.26A 5vkqB-2bl2A:
3.0
5vkqC-2bl2A:
3.1		 5vkqB-2bl2A:
8.05
5vkqC-2bl2A:
8.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2bll PROTEIN YFBG

(Escherichia
coli) 		PF01370
(Epimerase) 		5 GLY A 325
ILE A 320
GLY A 322
LEU A 389
ILE A 565
 None
 1.20A 5vkqB-2bllA:
1.0
5vkqC-2bllA:
1.0		 5vkqB-2bllA:
10.96
5vkqC-2bllA:
10.96
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.
2cuk GLYCERATE
DEHYDROGENASE/GLYOXY
LATE REDUCTASE

(Thermus
thermophilus) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		6 GLY A 251
LEU A 252
LEU A 210
VAL A 234
GLY A 249
LEU A 247
 None
 1.37A 5vkqB-2cukA:
undetectable
5vkqC-2cukA:
undetectable		 5vkqB-2cukA:
12.16
5vkqC-2cukA:
12.16
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.
2d1g ACID PHOSPHATASE

(Francisella
tularensis) 		PF04185
(Phosphoesterase) 		5 VAL A 439
ILE A 239
GLY A 240
LEU A 243
ILE A  34
 None
 1.20A 5vkqB-2d1gA:
undetectable
5vkqC-2d1gA:
undetectable		 5vkqB-2d1gA:
13.88
5vkqC-2d1gA:
13.88
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.
2d3i OVOTRANSFERRIN

(Gallus gallus) 		PF00405
(Transferrin) 		5 LEU A 267
LEU A  59
VAL A 252
ILE A   7
LEU A  34
 None
 1.26A 5vkqB-2d3iA:
undetectable
5vkqC-2d3iA:
undetectable		 5vkqB-2d3iA:
16.96
5vkqC-2d3iA:
16.96
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.
2dbr GLYOXYLATE REDUCTASE

(Pyrococcus
horikoshii) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 GLY A 263
LEU A 264
LEU A 221
VAL A 245
GLY A 261
 None
 1.05A 5vkqB-2dbrA:
undetectable
5vkqC-2dbrA:
undetectable		 5vkqB-2dbrA:
11.15
5vkqC-2dbrA:
11.15
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.
2di0 ACTIVATING SIGNAL
COINTEGRATOR 1
COMPLEX SUBUNIT 2

(Homo sapiens) 		PF02845
(CUE) 		5 LEU A  24
LEU A  16
VAL A  20
ILE A  50
LEU A  55
 None
 1.11A 5vkqB-2di0A:
undetectable
5vkqC-2di0A:
undetectable		 5vkqB-2di0A:
3.55
5vkqC-2di0A:
3.55
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.
2dwc 433AA LONG
HYPOTHETICAL
PHOSPHORIBOSYLGLYCIN
AMIDE FORMYL
TRANSFERASE

(Pyrococcus
horikoshii) 		PF02222
(ATP-grasp) 		5 GLY A 361
LEU A 362
LEU A 391
VAL A 373
LEU A 413
 None
 1.12A 5vkqB-2dwcA:
undetectable
5vkqC-2dwcA:
undetectable		 5vkqB-2dwcA:
13.37
5vkqC-2dwcA:
13.37
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.
2eb1 ENDORIBONUCLEASE
DICER

(Homo sapiens) 		PF00636
(Ribonuclease_3) 		5 LEU A  49
LEU A  25
ILE A  53
LEU A  54
ILE A  15
 None
 1.09A 5vkqB-2eb1A:
undetectable
5vkqC-2eb1A:
undetectable		 5vkqB-2eb1A:
7.55
5vkqC-2eb1A:
7.55
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.
2ec5 DERMONECROTIC TOXIN

(Pasteurella
multocida) 		PF11647
(MLD) 		5 GLY A 586
LEU A 587
LEU A 596
LEU A 668
ILE A 641
 None
 1.23A 5vkqB-2ec5A:
3.2
5vkqC-2ec5A:
4.1		 5vkqB-2ec5A:
17.85
5vkqC-2ec5A:
17.85
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.
2ek8 AMINOPEPTIDASE

(Aneurinibacillus
sp. AM-1) 		PF02225
(PA)
PF04389
(Peptidase_M28) 		5 GLY A 304
LEU A 385
LEU A 334
GLY A 244
LEU A 300
 None
 1.14A 5vkqB-2ek8A:
undetectable
5vkqC-2ek8A:
undetectable		 5vkqB-2ek8A:
13.68
5vkqC-2ek8A:
13.68
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.
2f5u VIRION PROTEIN UL25

(Human
alphaherpesvirus
1) 		PF01499
(Herpes_UL25) 		5 LEU A 460
LEU A 449
ILE A 388
GLY A 386
LEU A 271
 None
 1.12A 5vkqB-2f5uA:
undetectable
5vkqC-2f5uA:
undetectable		 5vkqB-2f5uA:
13.49
5vkqC-2f5uA:
13.49