SIMILAR PATTERNS OF AMINO ACIDS FOR 3VW1_B_CVIB301

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.
1bqy PLASMINOGEN
ACTIVATOR


(Trimeresurus
stejnegeri)
PF00089
(Trypsin)
5 LEU A 105
ILE A 212
ILE A 242
PHE A 209
LEU A 123
None
1.40A 3vw1B-1bqyA:
undetectable
3vw1B-1bqyA:
20.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e3h GUANOSINE
PENTAPHOSPHATE
SYNTHETASE


(Streptomyces
antibioticus)
PF00013
(KH_1)
PF01138
(RNase_PH)
PF03726
(PNPase)
5 LEU A 106
SER A 153
ILE A 102
ALA A 122
LEU A 246
None
1.43A 3vw1B-1e3hA:
0.0
3vw1B-1e3hA:
14.06
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1f1u HOMOPROTOCATECHUATE
2,3-DIOXYGENASE


(Arthrobacter
globiformis)
PF00903
(Glyoxalase)
5 LEU A  64
THR A 219
SER A  55
ILE A  23
LEU A 256
None
1.45A 3vw1B-1f1uA:
0.0
3vw1B-1f1uA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gzh TUMOR SUPPRESSOR
P53-BINDING PROTEIN
1


(Homo sapiens)
no annotation 5 LEU B1840
TYR B1732
PHE B1734
LEU B1803
LEU B1736
None
1.24A 3vw1B-1gzhB:
undetectable
3vw1B-1gzhB:
20.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1i60 IOLI PROTEIN

(Bacillus
subtilis)
PF01261
(AP_endonuc_2)
5 ILE A 198
SER A 244
TYR A 199
PHE A 239
LEU A 234
None
0.99A 3vw1B-1i60A:
undetectable
3vw1B-1i60A:
20.86
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.
1i9g HYPOTHETICAL PROTEIN
RV2118C


(Mycobacterium
tuberculosis)
PF08704
(GCD14)
PF14801
(GCD14_N)
5 ILE A  97
ALA A 253
LEU A 117
LEU A 255
LEU A 199
None
1.06A 3vw1B-1i9gA:
0.0
3vw1B-1i9gA:
24.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1j7j HYPOXANTHINE
PHOSPHORIBOSYLTRANSF
ERASE


(Salmonella
enterica)
PF00156
(Pribosyltran)
5 LEU A  86
THR A 107
ILE A  90
LEU A  41
LEU A 123
None
1.38A 3vw1B-1j7jA:
0.0
3vw1B-1j7jA:
21.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1jny ELONGATION FACTOR
1-ALPHA


(Sulfolobus
solfataricus)
PF00009
(GTP_EFTU)
PF03143
(GTP_EFTU_D3)
PF03144
(GTP_EFTU_D2)
5 LEU A 222
ALA A 108
LEU A 215
PHE A  79
LEU A  27
None
1.38A 3vw1B-1jnyA:
0.0
3vw1B-1jnyA:
16.97
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.
1k8g TELOMERE-BINDING
PROTEIN ALPHA
SUBUNIT


(Sterkiella nova)
PF02765
(POT1)
5 LEU A 189
TYR A  55
ILE A 181
ALA A 179
LEU A 100
None
None
None
SO4  A 322 ( 4.3A)
None
1.12A 3vw1B-1k8gA:
undetectable
3vw1B-1k8gA:
22.02
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.
1kwc 2,3-DIHYDROXYBIPHENY
L DIOXYGENASE


(Pseudomonas sp.
KKS102)
PF00903
(Glyoxalase)
5 LEU B   8
ILE B 143
ALA B  42
LEU B 212
LEU B 227
None
1.03A 3vw1B-1kwcB:
0.0
3vw1B-1kwcB:
21.85
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.
1kwc 2,3-DIHYDROXYBIPHENY
L DIOXYGENASE


(Pseudomonas sp.
KKS102)
PF00903
(Glyoxalase)
5 LEU B   8
ILE B 257
ILE B 143
ALA B  42
LEU B 212
None
1.08A 3vw1B-1kwcB:
0.0
3vw1B-1kwcB:
21.85
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.
1nr0 ACTIN INTERACTING
PROTEIN 1


(Caenorhabditis
elegans)
PF00400
(WD40)
PF12894
(ANAPC4_WD40)
5 LEU A 330
ILE A 353
ILE A 327
LEU A 590
PHE A  10
None
1.44A 3vw1B-1nr0A:
undetectable
3vw1B-1nr0A:
16.67
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.
1nr6 CYTOCHROME P450 2C5

(Oryctolagus
cuniculus)
PF00067
(p450)
5 ILE A 169
ALA A 317
LEU A 152
PHE A 484
LEU A 455
None
1.00A 3vw1B-1nr6A:
0.8
3vw1B-1nr6A:
20.09
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.
1ph5 TELOMERE-BINDING
PROTEIN ALPHA
SUBUNIT


(Sterkiella nova)
PF02765
(POT1)
5 LEU A 189
TYR A  55
ILE A 181
ALA A 179
LEU A 100
None
1.10A 3vw1B-1ph5A:
undetectable
3vw1B-1ph5A:
17.92
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.
1s58 B19 PARVOVIRUS
CAPSID


(Primate
erythroparvovirus
1)
PF00740
(Parvo_coat)
5 LEU A  97
TYR A 422
ALA A  29
LEU A 426
LEU A 242
None
1.34A 3vw1B-1s58A:
undetectable
3vw1B-1s58A:
16.46
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.
1tyd TYROSYL-TRNA
SYNTHETASE


(Geobacillus
stearothermophilus)
PF00579
(tRNA-synt_1b)
5 SER E  43
ILE E 120
ALA E 118
PHE E 108
LEU E 305
None
1.29A 3vw1B-1tydE:
0.0
3vw1B-1tydE:
23.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wox HEME OXYGENASE 2

(Synechocystis
sp. PCC 6803)
PF01126
(Heme_oxygenase)
5 TYR A 104
ILE A  65
ALA A 198
LEU A  56
LEU A 178
None
1.03A 3vw1B-1woxA:
1.8
3vw1B-1woxA:
22.31
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.
1xzz INOSITOL
1,4,5-TRISPHOSPHATE
RECEPTOR TYPE 1


(Mus musculus)
PF08709
(Ins145_P3_rec)
5 LEU A 184
ILE A  27
ILE A 163
LEU A  60
LEU A 126
None
1.45A 3vw1B-1xzzA:
undetectable
3vw1B-1xzzA:
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.
1z34 PURINE NUCLEOSIDE
PHOSPHORYLASE


(Trichomonas
vaginalis)
PF01048
(PNP_UDP_1)
5 LEU A 229
ILE A 199
ILE A  57
ALA A  13
LEU A 185
None
1.27A 3vw1B-1z34A:
undetectable
3vw1B-1z34A:
20.51
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.
1z6g GUANYLATE KINASE

(Plasmodium
falciparum)
PF00625
(Guanylate_kin)
5 ILE A 191
TYR A 190
PHE A  32
LEU A   7
LEU A  25
None
1.35A 3vw1B-1z6gA:
undetectable
3vw1B-1z6gA:
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.
2bvg 6-HYDROXY-D-NICOTINE
OXIDASE


(Paenarthrobacter
nicotinovorans)
PF01565
(FAD_binding_4)
PF08031
(BBE)
5 ILE A 158
ILE A  96
PHE A 135
LEU A 114
LEU A 138
None
None
None
None
FAD  A 600 (-3.9A)
1.29A 3vw1B-2bvgA:
undetectable
3vw1B-2bvgA:
19.21
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.
2elj TRANSCRIPTIONAL
ADAPTER 2


(Saccharomyces
cerevisiae)
PF04433
(SWIRM)
5 ILE A  78
ILE A  14
ALA A  17
LEU A  44
LEU A  23
None
1.14A 3vw1B-2eljA:
undetectable
3vw1B-2eljA:
15.90
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.
2fuq HEPARINASE II
PROTEIN


(Pedobacter
heparinus)
PF07940
(Hepar_II_III)
PF16332
(DUF4962)
5 LEU A 168
THR A 156
TYR A 161
PHE A 180
LEU A 183
None
1.21A 3vw1B-2fuqA:
undetectable
3vw1B-2fuqA:
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.
2g4b SPLICING FACTOR U2AF
65 KDA SUBUNIT


(Homo sapiens)
PF00076
(RRM_1)
5 LEU A 224
THR A 161
ILE A 160
ILE A 226
LEU A 200
None
1.24A 3vw1B-2g4bA:
undetectable
3vw1B-2g4bA:
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.
2glj PROBABLE M18-FAMILY
AMINOPEPTIDASE 1


(Clostridium
acetobutylicum)
PF02127
(Peptidase_M18)
5 LEU A 225
ILE A 151
ILE A 221
ALA A 125
LEU A 127
None
1.40A 3vw1B-2gljA:
undetectable
3vw1B-2gljA:
18.54
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.
2jig PROLYL-4 HYDROXYLASE

(Chlamydomonas
reinhardtii)
PF13640
(2OG-FeII_Oxy_3)
5 LEU A 129
THR A 119
ILE A  66
PHE A  57
LEU A  58
None
1.12A 3vw1B-2jigA:
undetectable
3vw1B-2jigA:
18.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2okc TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN


(Bacteroides
thetaiotaomicron)
PF02384
(N6_Mtase)
PF12161
(HsdM_N)
5 LEU A 296
THR A 359
ILE A 256
ALA A 258
LEU A 324
None
1.37A 3vw1B-2okcA:
undetectable
3vw1B-2okcA:
18.08
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pkg SERINE/THREONINE-PRO
TEIN PHOSPHATASE 2A
65 KDA REGULATORY
SUBUNIT A ALPHA
ISOFORM


(Homo sapiens)
PF02985
(HEAT)
PF13646
(HEAT_2)
5 THR A 481
ILE A 482
ILE A 424
ALA A 412
PHE A 439
None
1.19A 3vw1B-2pkgA:
undetectable
3vw1B-2pkgA:
14.26
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.
2v8j PECTATE LYASE

(Yersinia
enterocolitica)
PF06917
(Pectate_lyase_2)
5 LEU A 214
TYR A 210
ALA A 505
LEU A 314
LEU A 508
None
1.03A 3vw1B-2v8jA:
undetectable
3vw1B-2v8jA:
17.17
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wb7 PT26-6P

(Thermococcus
sp. 26-2)
no annotation 5 THR A 415
ILE A 283
ALA A 286
PHE A 453
LEU A 485
None
1.32A 3vw1B-2wb7A:
2.1
3vw1B-2wb7A:
18.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wtk SERINE/THREONINE-PRO
TEIN KINASE 11


(Homo sapiens)
PF00069
(Pkinase)
5 LEU C 182
THR C 249
ILE C 248
ILE C 192
LEU C 285
None
1.07A 3vw1B-2wtkC:
undetectable
3vw1B-2wtkC:
20.13
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.
2y8c DEOXYURIDINE
5'-TRIPHOSPHATE
NUCLEOTIDOHYDROLASE


(Plasmodium
falciparum)
PF00692
(dUTPase)
5 LEU A   3
SER A 141
ILE A   5
LEU A  31
LEU A 101
None
1.24A 3vw1B-2y8cA:
undetectable
3vw1B-2y8cA:
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.
2zr2 SERYL-TRNA
SYNTHETASE


(Pyrococcus
horikoshii)
PF00587
(tRNA-synt_2b)
PF02403
(Seryl_tRNA_N)
5 TYR A 186
LEU A 166
ILE A 443
ILE A 296
LEU A 434
None
1.15A 3vw1B-2zr2A:
undetectable
3vw1B-2zr2A:
19.01
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.
3b2d CD180 ANTIGEN

(Homo sapiens)
PF00560
(LRR_1)
PF13855
(LRR_8)
5 LEU A 140
ILE A 185
ALA A 172
LEU A 196
LEU A 227
None
1.20A 3vw1B-3b2dA:
undetectable
3vw1B-3b2dA:
13.99
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.
3brc CONSERVED PROTEIN OF
UNKNOWN FUNCTION


(Methanothermobacter
thermautotrophicus)
PF11576
(DUF3236)
5 LEU A  96
SER A  35
ILE A  98
PHE A 154
LEU A 149
None
1.00A 3vw1B-3brcA:
undetectable
3vw1B-3brcA:
23.00
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.
3can PYRUVATE-FORMATE
LYASE-ACTIVATING
ENZYME


(Bacteroides
vulgatus)
PF04055
(Radical_SAM)
5 TYR A  98
LEU A  65
ILE A  88
ALA A  92
LEU A 174
None
0.90A 3vw1B-3canA:
undetectable
3vw1B-3canA:
19.81
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.
3can PYRUVATE-FORMATE
LYASE-ACTIVATING
ENZYME


(Bacteroides
vulgatus)
PF04055
(Radical_SAM)
5 TYR A  98
LEU A  65
ILE A 115
ILE A  88
LEU A 174
None
1.17A 3vw1B-3canA:
undetectable
3vw1B-3canA:
19.81
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.
3d3l ARACHIDONATE
12-LIPOXYGENASE,
12S-TYPE


(Homo sapiens)
PF00305
(Lipoxygenase)
5 LEU A 389
THR A 503
ILE A 502
PHE A 519
LEU A 525
None
1.09A 3vw1B-3d3lA:
undetectable
3vw1B-3d3lA:
15.78
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.
3eh0 UDP-3-O-[3-HYDROXYMY
RISTOYL] GLUCOSAMINE
N-ACYLTRANSFERASE


(Escherichia
coli)
PF00132
(Hexapep)
PF04613
(LpxD)
PF14602
(Hexapep_2)
5 LEU A 130
ILE A 166
SER A 146
ILE A 118
ALA A  97
None
1.46A 3vw1B-3eh0A:
undetectable
3vw1B-3eh0A:
20.29
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.
3fvq FE(3+) IONS IMPORT
ATP-BINDING PROTEIN
FBPC


(Neisseria
gonorrhoeae)
PF00005
(ABC_tran)
5 LEU A 185
ILE A 160
ALA A 152
PHE A 166
LEU A 169
None
1.09A 3vw1B-3fvqA:
undetectable
3vw1B-3fvqA:
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.
3g8z PROTEIN OF UNKNOWN
FUNCTION WITH
CYSTATIN-LIKE FOLD


(Xanthomonas
campestris)
PF12680
(SnoaL_2)
5 TYR A  73
LEU A 103
ILE A  26
ILE A  82
ALA A  70
None
None
None
None
CL  A 131 (-4.3A)
1.09A 3vw1B-3g8zA:
undetectable
3vw1B-3g8zA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gkb PUTATIVE ENOYL-COA
HYDRATASE


(Streptomyces
avermitilis)
PF00378
(ECH_1)
5 LEU A   9
THR A 107
LEU A  42
PHE A 122
LEU A  65
None
1.15A 3vw1B-3gkbA:
undetectable
3vw1B-3gkbA:
20.96
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.
3hjn THYMIDYLATE KINASE

(Thermotoga
maritima)
PF02223
(Thymidylate_kin)
5 SER A  94
TYR A  97
ALA A 135
PHE A 150
LEU A 151
TYD  A 401 (-2.7A)
TYD  A 401 (-3.8A)
None
None
None
1.34A 3vw1B-3hjnA:
undetectable
3vw1B-3hjnA:
23.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3jv9 TRANSCRIPTIONAL
REGULATOR, LYSR
FAMILY


(Neisseria
meningitidis)
PF03466
(LysR_substrate)
5 LEU A 105
THR A 129
ILE A  98
LEU A  95
LEU A 136
None
CL  A 307 (-4.2A)
None
None
None
1.38A 3vw1B-3jv9A:
undetectable
3vw1B-3jv9A:
21.37
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.
3k7d GLUTAMATE-AMMONIA-LI
GASE
ADENYLYLTRANSFERASE


(Escherichia
coli)
PF03710
(GlnE)
PF08335
(GlnD_UR_UTase)
5 LEU A 532
ILE A 556
ILE A 535
LEU A 576
LEU A 585
None
1.10A 3vw1B-3k7dA:
undetectable
3vw1B-3k7dA:
17.84
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.
3lf2 SHORT CHAIN
OXIDOREDUCTASE
Q9HYA2


(Pseudomonas
aeruginosa)
PF13561
(adh_short_C2)
5 SER A  17
ILE A 239
ALA A 243
LEU A  28
LEU A  85
NDP  A 301 (-2.7A)
None
None
None
None
0.99A 3vw1B-3lf2A:
undetectable
3vw1B-3lf2A:
24.15
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3mil ISOAMYL
ACETATE-HYDROLYZING
ESTERASE


(Saccharomyces
cerevisiae)
PF13472
(Lipase_GDSL_2)
5 ILE A 207
ALA A  17
LEU A 204
PHE A   6
LEU A   8
None
1.00A 3vw1B-3milA:
undetectable
3vw1B-3milA:
22.57
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.
3mwt NUCLEOPROTEIN

(Lassa
mammarenavirus)
PF00843
(Arena_nucleocap)
PF17290
(Arena_ncap_C)
5 LEU A 470
ILE A 479
ILE A 390
ALA A 530
LEU A 380
None
1.50A 3vw1B-3mwtA:
undetectable
3vw1B-3mwtA:
16.29
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.
3naw SECRETED EFFECTOR
PROTEIN


(Escherichia
coli)
PF00805
(Pentapeptide)
PF13979
(SopA_C)
PF13981
(SopA)
5 LEU A 615
ILE A 711
ILE A 611
LEU A 719
LEU A 744
None
1.05A 3vw1B-3nawA:
undetectable
3vw1B-3nawA:
15.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3naw SECRETED EFFECTOR
PROTEIN


(Escherichia
coli)
PF00805
(Pentapeptide)
PF13979
(SopA_C)
PF13981
(SopA)
5 LEU A 615
ILE A 711
TYR A 715
ILE A 611
LEU A 719
None
1.34A 3vw1B-3nawA:
undetectable
3vw1B-3nawA:
15.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q7b NUCLEOPROTEIN

(Lassa
mammarenavirus)
PF17290
(Arena_ncap_C)
5 LEU A 470
ILE A 479
ILE A 390
ALA A 530
LEU A 380
None
1.44A 3vw1B-3q7bA:
undetectable
3vw1B-3q7bA:
20.73
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3q88 GLUCOSE-6-PHOSPHATE
ISOMERASE


(Francisella
tularensis)
PF00342
(PGI)
5 LEU A  53
TYR A  43
PHE A  41
LEU A  34
LEU A 479
None
1.05A 3vw1B-3q88A:
undetectable
3vw1B-3q88A:
15.72
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.
3qp5 CVIR TRANSCRIPTIONAL
REGULATOR


(Chromobacterium
violaceum)
PF00196
(GerE)
PF03472
(Autoind_bind)
5 TYR A  88
LEU A  57
ALA A  94
LEU A  72
LEU A  63
HLC  A 266 (-4.5A)
HLC  A 266 (-4.7A)
None
None
None
1.34A 3vw1B-3qp5A:
undetectable
3vw1B-3qp5A:
21.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3sdq ALPHA-BISABOLENE
SYNTHASE


(Abies grandis)
PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C)
5 LEU A 140
ILE A 159
LEU A 197
PHE A 183
LEU A 207
None
1.45A 3vw1B-3sdqA:
2.0
3vw1B-3sdqA:
14.04
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.
3suc PRENECK APPENDAGE
PROTEIN


(Bacillus virus
phi29)
PF11962
(Peptidase_G2)
PF12708
(Pectate_lyase_3)
5 LEU A 149
ILE A 229
ILE A 128
LEU A 219
PHE A 195
None
1.39A 3vw1B-3sucA:
undetectable
3vw1B-3sucA:
13.92
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.
3voc BETA/ALPHA-AMYLASE

(Paenibacillus
polymyxa)
PF01373
(Glyco_hydro_14)
5 TYR A 137
ILE A 260
ALA A 264
PHE A 312
LEU A 317
None
1.49A 3vw1B-3vocA:
undetectable
3vw1B-3vocA:
18.05
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vw1 PUTATIVE REGULATORY
PROTEIN


(Salmonella
enterica)
PF00440
(TetR_N)
9 TYR A  59
LEU A  66
THR A  85
ILE A  88
SER A  91
TYR A  92
ILE A 106
ALA A 110
LEU A 130
None
0.66A 3vw1B-3vw1A:
28.7
3vw1B-3vw1A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vw1 PUTATIVE REGULATORY
PROTEIN


(Salmonella
enterica)
PF00440
(TetR_N)
9 TYR A  59
LEU A  66
THR A  85
ILE A  88
SER A  91
TYR A  92
ILE A 106
LEU A 130
PHE A 155
None
0.70A 3vw1B-3vw1A:
28.7
3vw1B-3vw1A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vw1 PUTATIVE REGULATORY
PROTEIN


(Salmonella
enterica)
PF00440
(TetR_N)
9 TYR A  59
LEU A  66
THR A  85
SER A  91
TYR A  92
ILE A 106
ALA A 110
LEU A 130
LEU A 188
None
0.68A 3vw1B-3vw1A:
28.7
3vw1B-3vw1A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vw1 PUTATIVE REGULATORY
PROTEIN


(Salmonella
enterica)
PF00440
(TetR_N)
9 TYR A  59
LEU A  66
THR A  85
SER A  91
TYR A  92
ILE A 106
LEU A 130
PHE A 155
LEU A 188
None
0.68A 3vw1B-3vw1A:
28.7
3vw1B-3vw1A:
100.00
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3vw1 PUTATIVE REGULATORY
PROTEIN


(Salmonella
enterica)
PF00440
(TetR_N)
9 TYR A  59
LEU A  66
THR A  85
SER A  91
TYR A  92
ILE A 106
PHE A 155
LEU A 156
LEU A 188
None
0.68A 3vw1B-3vw1A:
28.7
3vw1B-3vw1A:
100.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4a5q CHI1

(Yersinia
entomophaga)
PF00704
(Glyco_hydro_18)
5 TYR A  80
SER A 211
TYR A 115
PHE A 196
LEU A 199
None
1.39A 3vw1B-4a5qA:
undetectable
3vw1B-4a5qA:
17.43
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.
4bpz ENDO-1,3-BETA-GLUCAN
ASE, FAMILY GH16


(Zobellia
galactanivorans)
PF00722
(Glyco_hydro_16)
5 LEU A 329
SER A 317
TYR A 316
ILE A 306
LEU A 231
None
1.39A 3vw1B-4bpzA:
undetectable
3vw1B-4bpzA:
18.49
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.
4d53 BB0689

(Borreliella
burgdorferi)
PF00188
(CAP)
5 ILE A  16
SER A  19
TYR A  18
ALA A  43
LEU A  89
None
0.96A 3vw1B-4d53A:
undetectable
3vw1B-4d53A:
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.
4db3 N-ACETYL-D-GLUCOSAMI
NE KINASE


(Vibrio
vulnificus)
PF00480
(ROK)
5 TYR A 262
ILE A 240
ILE A 261
PHE A 134
LEU A 130
None
1.10A 3vw1B-4db3A:
undetectable
3vw1B-4db3A:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4de8 CPS2A

(Streptococcus
pneumoniae)
PF02916
(DNA_PPF)
PF03816
(LytR_cpsA_psr)
5 LEU A 405
SER A 317
ILE A 401
ALA A 394
LEU A 325
None
1.17A 3vw1B-4de8A:
undetectable
3vw1B-4de8A:
18.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4du6 GTP CYCLOHYDROLASE 1

(Yersinia pestis)
PF01227
(GTP_cyclohydroI)
5 LEU A 161
ILE A  85
ILE A 157
ALA A 144
PHE A  82
None
1.37A 3vw1B-4du6A:
undetectable
3vw1B-4du6A:
23.61
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.
4egx KINESIN-LIKE PROTEIN
KIF1A


(Homo sapiens)
PF00498
(FHA)
PF16183
(Kinesin_assoc)
5 LEU A 531
ILE A 585
SER A 589
ILE A 529
LEU A 494
None
1.48A 3vw1B-4egxA:
undetectable
3vw1B-4egxA:
24.67
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.
4ese FMN-DEPENDENT
NADH-AZOREDUCTASE


(Yersinia pestis)
PF02525
(Flavodoxin_2)
5 THR A 118
ILE A 137
ALA A  94
LEU A  84
PHE A 160
None
1.20A 3vw1B-4eseA:
undetectable
3vw1B-4eseA:
24.00
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.
4h7u PYRANOSE
DEHYDROGENASE


(Leucoagaricus
meleagris)
PF00732
(GMC_oxred_N)
PF05199
(GMC_oxred_C)
5 TYR A 212
THR A 185
ALA A 360
LEU A 207
PHE A 178
None
1.47A 3vw1B-4h7uA:
undetectable
3vw1B-4h7uA:
15.64
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.
4hea NADH-QUINONE
OXIDOREDUCTASE
SUBUNIT 13


(Thermus
thermophilus)
PF00361
(Proton_antipo_M)
5 LEU M 233
SER M 318
ALA M  86
LEU M 327
LEU M 357
None
1.45A 3vw1B-4heaM:
2.4
3vw1B-4heaM:
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.
4hqf THROMBOSPONDIN-RELAT
ED ANONYMOUS
PROTEIN, TRAP


(Plasmodium
falciparum)
PF00092
(VWA)
5 LEU A 122
ILE A 118
LEU A 160
LEU A  88
LEU A 156
None
1.22A 3vw1B-4hqfA:
undetectable
3vw1B-4hqfA:
21.35
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.
4krf PROTEIN ARGONAUTE-1

(Homo sapiens)
PF02170
(PAZ)
PF02171
(Piwi)
PF08699
(ArgoL1)
PF16486
(ArgoN)
PF16487
(ArgoMid)
PF16488
(ArgoL2)
5 LEU A 213
ILE A 397
TYR A 386
ILE A 215
LEU A 160
None
1.29A 3vw1B-4krfA:
undetectable
3vw1B-4krfA:
12.54
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.
4mlo TCP PILUS VIRULENCE
REGULATORY PROTEIN


(Vibrio cholerae)
PF00165
(HTH_AraC)
5 ILE A  58
SER A  56
ILE A  79
LEU A  71
LEU A 114
None
None
None
PAM  A 304 ( 4.9A)
None
1.33A 3vw1B-4mloA:
3.5
3vw1B-4mloA:
21.20
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.
4n18 D-ISOMER SPECIFIC
2-HYDROXYACID
DEHYDROGENASE FAMILY
PROTEIN


(Klebsiella
pneumoniae)
PF02826
(2-Hacid_dh_C)
5 LEU A 196
ILE A 205
LEU A 142
PHE A 185
LEU A 182
None
1.49A 3vw1B-4n18A:
undetectable
3vw1B-4n18A:
23.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4na3 POLYKETIDE SYNTHASE
PKSJ


(Bacillus
subtilis)
PF00109
(ketoacyl-synt)
PF02801
(Ketoacyl-synt_C)
PF16197
(KAsynt_C_assoc)
5 LEU A 374
THR A 268
ILE A 440
ILE A  12
ALA A 103
None
1.42A 3vw1B-4na3A:
undetectable
3vw1B-4na3A:
15.05
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.
4rh7 GREEN FLUORESCENT
PROTEIN/CYTOPLASMIC
DYNEIN 2 HEAVY CHAIN
1


(Homo sapiens;
synthetic
construct)
PF03028
(Dynein_heavy)
PF07728
(AAA_5)
PF08393
(DHC_N2)
PF12774
(AAA_6)
PF12775
(AAA_7)
PF12777
(MT)
PF12780
(AAA_8)
PF12781
(AAA_9)
5 LEU A4183
ILE A4217
ILE A4072
LEU A4170
LEU A4163
None
0.97A 3vw1B-4rh7A:
undetectable
3vw1B-4rh7A:
4.55
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.
4s2t PROTEIN APP-1

(Caenorhabditis
elegans)
PF00557
(Peptidase_M24)
PF01321
(Creatinase_N)
PF16188
(Peptidase_M24_C)
PF16189
(Creatinase_N_2)
5 LEU P 204
ILE P 239
TYR P 225
ILE P 218
LEU P 163
None
1.19A 3vw1B-4s2tP:
undetectable
3vw1B-4s2tP:
15.49
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.
4x9e DEOXYGUANOSINETRIPHO
SPHATE
TRIPHOSPHOHYDROLASE


(Escherichia
coli)
PF01966
(HD)
5 LEU A 356
ILE A 263
ILE A   4
PHE A 106
LEU A  99
None
1.23A 3vw1B-4x9eA:
undetectable
3vw1B-4x9eA:
17.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4zyj DNMZ

(Streptomyces
peucetius)
PF00441
(Acyl-CoA_dh_1)
PF02770
(Acyl-CoA_dh_M)
PF02771
(Acyl-CoA_dh_N)
5 ILE A  93
ILE A 178
LEU A  40
LEU A  67
LEU A  32
None
0.96A 3vw1B-4zyjA:
3.1
3vw1B-4zyjA:
19.53
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.
5bop NANOBODY
OCTARELLIN V.1


(Lama glama;
synthetic
construct)
PF07686
(V-set)
no annotation
5 LEU A 102
THR A  54
ILE B   5
ALA B 110
LEU B  49
None
1.45A 3vw1B-5bopA:
undetectable
3vw1B-5bopA:
21.65
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.
5dil NON-STRUCTURAL
PROTEIN 1


(Influenza B
virus)
PF02942
(Flu_B_NS1)
5 ILE A 239
ILE A 255
ALA A 257
LEU A 173
LEU A 265
None
1.13A 3vw1B-5dilA:
undetectable
3vw1B-5dilA:
23.71
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.
5esy SAL1 PHOSPHATASE

(Arabidopsis
thaliana)
PF00459
(Inositol_P)
5 LEU A 275
SER A 241
ILE A 273
ALA A 225
LEU A 248
None
1.28A 3vw1B-5esyA:
undetectable
3vw1B-5esyA:
21.90
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.
5fn4 GAMMA-SECRETASE
SUBUNIT APH-1A


(Homo sapiens)
PF06105
(Aph-1)
5 ILE C 168
SER C 129
ILE C 137
ALA C 141
PHE C  14
None
1.21A 3vw1B-5fn4C:
3.8
3vw1B-5fn4C:
21.48
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5irr SEPTIN-LIKE PROTEIN

(Chlamydomonas
reinhardtii)
PF00735
(Septin)
5 LEU A 373
TYR A 175
ILE A 376
LEU A 113
LEU A 126
None
1.28A 3vw1B-5irrA:
undetectable
3vw1B-5irrA:
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.
5l09 QUORUM-SENSING
TRANSCRIPTIONAL
ACTIVATOR


(Yersinia
enterocolitica)
PF03472
(Autoind_bind)
5 TYR A  50
LEU A  29
SER A 139
PHE A 112
LEU A 124
482  A 201 (-4.5A)
None
None
None
None
1.41A 3vw1B-5l09A:
undetectable
3vw1B-5l09A:
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.
5u94 SERINE/THREONINE-PRO
TEIN KINASE PKNB


(Mycobacterium
tuberculosis)
no annotation 5 LEU A 202
THR A 179
ILE A 119
ALA A 115
LEU A 100
None
GOL  A 304 (-3.6A)
None
None
None
1.33A 3vw1B-5u94A:
undetectable
3vw1B-5u94A:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5vtg TRANSLOCATION AND
ASSEMBLY MODULE
SUBUNIT TAMB


(Escherichia
coli)
no annotation 5 LEU A1045
ILE A 991
ALA A1125
LEU A1089
LEU A1053
None
1.42A 3vw1B-5vtgA:
undetectable
3vw1B-5vtgA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5y3r DNA-DEPENDENT
PROTEIN KINASE
CATALYTIC SUBUNIT


(Homo sapiens)
PF00454
(PI3_PI4_kinase)
PF02259
(FAT)
PF02260
(FATC)
PF08163
(NUC194)
5 TYR C3013
THR C2949
ILE C2952
SER C2955
ALA C3017
None
1.26A 3vw1B-5y3rC:
undetectable
3vw1B-5y3rC:
4.08
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.
5yfg RAN GUANINE
NUCLEOTIDE RELEASE
FACTOR


(Homo sapiens)
no annotation 5 THR A   4
ILE A  17
SER A  15
ALA A 102
LEU A  93
None
1.43A 3vw1B-5yfgA:
undetectable
3vw1B-5yfgA:
22.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5yhp COLD ACTIVE PROLINE
IMINOPEPTIDASE


(Glaciozyma
antarctica)
no annotation 5 LEU A 131
ILE A 136
ALA A 123
LEU A 280
LEU A 139
None
1.23A 3vw1B-5yhpA:
undetectable
3vw1B-5yhpA:
18.47
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.
6b8s DIHYDROOROTATE
DEHYDROGENASE
(QUINONE)


(Helicobacter
pylori)
no annotation 5 LEU A 169
TYR A 175
ALA A 125
PHE A 177
LEU A 146
None
1.45A 3vw1B-6b8sA:
undetectable
3vw1B-6b8sA:
undetectable
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6cf8 LYTIC
TRANSGLYCOSYLASE


(Campylobacter
jejuni)
no annotation 5 TYR A 283
ILE A 531
ILE A 282
LEU A 457
LEU A 474
None
1.19A 3vw1B-6cf8A:
undetectable
3vw1B-6cf8A:
undetectable