SIMILAR PATTERNS OF AMINO ACIDS FOR 2VDV_F_SAMF1287_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.
1l3x PLATELET AGGREGATION
INHIBITOR
DISINTEGRIN

(Gloydius
brevicaudus) 		PF00200
(Disintegrin) 		5 GLY A  32
GLY A   3
GLU A  31
ARG A  51
ASN A  13
 None
 1.20A 2vdvF-1l3xA:
undetectable		 2vdvF-1l3xA:
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.
1lwu FIBRINOGEN BETA
CHAIN
FIBRINOGEN GAMMA
CHAIN

(Petromyzon
marinus;
Petromyzon
marinus) 		PF00147
(Fibrinogen_C)
PF08702
(Fib_alpha)
PF00147
(Fibrinogen_C) 		5 GLY C 216
ILE B 305
ARG B 223
ASN B 307
GLU C 225
 None
 1.20A 2vdvF-1lwuC:
undetectable		 2vdvF-1lwuC:
22.08
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.
1nq6 XYS1

(Streptomyces
halstedii) 		PF00331
(Glyco_hydro_10) 		5 GLY A 240
GLY A 280
ILE A 238
ASN A 248
ALA A 244
 None
 1.12A 2vdvF-1nq6A:
undetectable		 2vdvF-1nq6A:
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.
1qp8 FORMATE
DEHYDROGENASE

(Pyrobaculum
aerophilum) 		PF00389
(2-Hacid_dh)
PF02826
(2-Hacid_dh_C) 		5 GLY A 133
GLU A 134
ASN A  78
ALA A  59
ASP A  84
 NDP  A 310 (-4.5A)
None
None
NDP  A 310 (-3.4A)
None
 1.17A 2vdvF-1qp8A:
4.1		 2vdvF-1qp8A:
20.83
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.
1rvk ISOMERASE/LACTONIZIN
G ENZYME

(Agrobacterium
fabrum) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A 256
ILE A 231
ALA A 216
ASP A 206
GLU A 258
 None
None
None
MG  A 999 (-2.7A)
MG  A 999 (-2.5A)
 1.27A 2vdvF-1rvkA:
undetectable		 2vdvF-1rvkA:
18.70
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.
1vhe AMINOPEPTIDASE/GLUCA
NASE HOMOLOG

(Bacillus
subtilis) 		PF05343
(Peptidase_M42) 		5 GLY A 186
ILE A 319
ASP A 182
THR A 211
GLU A 214
 None
None
ZN  A 372 (-2.5A)
None
ZN  A 372 ( 3.9A)
 1.26A 2vdvF-1vheA:
undetectable		 2vdvF-1vheA:
24.42
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.
1vlm SAM-DEPENDENT
METHYLTRANSFERASE

(Thermotoga
maritima) 		PF08241
(Methyltransf_11) 		5 GLY A  43
GLY A  45
GLU A  60
ALA A  81
PHE A  49
 NA  A 300 (-4.1A)
None
None
None
None
 1.15A 2vdvF-1vlmA:
9.2		 2vdvF-1vlmA:
22.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yzh TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Streptococcus
pneumoniae) 		PF02390
(Methyltransf_4) 		5 GLY A  46
GLY A  48
ILE A  70
PHE A 116
THR A 191
 None
 0.55A 2vdvF-1yzhA:
17.6		 2vdvF-1yzhA:
22.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1yzh TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Streptococcus
pneumoniae) 		PF02390
(Methyltransf_4) 		5 GLY A  46
GLY A  48
PHE A 116
ASP A 118
THR A 191
 None
 0.75A 2vdvF-1yzhA:
17.6		 2vdvF-1yzhA:
22.92
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1z2z PROBABLE TRNA
PSEUDOURIDINE
SYNTHASE D

(Methanosarcina
mazei) 		PF01142
(TruD) 		5 GLY A 119
GLY A  44
GLU A  45
ALA A 102
GLU A  42
 None
 1.18A 2vdvF-1z2zA:
undetectable		 2vdvF-1z2zA:
19.87
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1zmb ACETYLXYLAN ESTERASE
RELATED ENZYME

(Clostridium
acetobutylicum) 		PF03629
(SASA) 		5 GLY A  17
GLY A  15
ILE A  19
ASN A  20
PHE A 216
 None
 1.19A 2vdvF-1zmbA:
3.2		 2vdvF-1zmbA:
23.15
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.
2a4m TRYPTOPHANYL-TRNA
SYNTHETASE II

(Deinococcus
radiodurans) 		PF00579
(tRNA-synt_1b) 		5 GLY A  38
GLY A  42
ARG A 206
ASN A 222
ALA A 223
 None
 1.20A 2vdvF-2a4mA:
undetectable		 2vdvF-2a4mA:
21.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e4u METABOTROPIC
GLUTAMATE RECEPTOR 3

(Rattus
norvegicus) 		PF01094
(ANF_receptor)
PF07562
(NCD3G) 		5 GLY A 223
GLU A 224
PHE A 230
THR A 215
GLU A 231
 None
 1.29A 2vdvF-2e4uA:
undetectable		 2vdvF-2e4uA:
16.70
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.
2erq VASCULAR
APOPTOSIS-INDUCING
PROTEIN 1

(Crotalus atrox) 		PF00200
(Disintegrin)
PF01421
(Reprolysin)
PF08516
(ADAM_CR) 		5 GLY A 304
GLU A 336
ILE A 318
ALA A 316
ASP A 265
 None
ZN  A 700 ( 4.3A)
None
None
None
 1.23A 2vdvF-2erqA:
undetectable		 2vdvF-2erqA:
17.78
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.
2faf PHOSPHOENOLPYRUVATE
CARBOXYKINASE

(Gallus gallus) 		PF00821
(PEPCK_C)
PF17297
(PEPCK_N) 		5 GLY A 561
GLY A 565
ILE A 559
ALA A 557
ASP A 448
 None
 1.26A 2vdvF-2fafA:
undetectable		 2vdvF-2fafA:
15.51
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.
2fca TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Bacillus
subtilis) 		PF02390
(Methyltransf_4) 		6 GLY A  46
GLY A  48
GLU A  69
ALA A  97
PHE A 116
THR A 191
 K  A 250 (-3.9A)
None
None
None
None
None
 0.69A 2vdvF-2fcaA:
17.6		 2vdvF-2fcaA:
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.
2fca TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Bacillus
subtilis) 		PF02390
(Methyltransf_4) 		6 GLY A  46
GLY A  48
GLU A  69
PHE A 116
ASP A 118
THR A 191
 K  A 250 (-3.9A)
None
None
None
None
None
 0.70A 2vdvF-2fcaA:
17.6		 2vdvF-2fcaA:
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.
2hms YUAA PROTEIN

(Bacillus
subtilis) 		PF02254
(TrkA_N) 		5 GLY A  13
GLY A  15
ILE A  37
ASN A  56
ALA A  57
 NAI  A 601 (-3.3A)
NAI  A 601 (-3.2A)
NAI  A 601 (-3.8A)
NAI  A 601 (-3.6A)
NAI  A 601 (-3.8A)
 1.09A 2vdvF-2hmsA:
6.4		 2vdvF-2hmsA:
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.
2j8k NP275-NP276

(Nostoc
punctiforme) 		PF00805
(Pentapeptide) 		5 GLY A  59
GLY A  39
ILE A  81
ASN A 101
ALA A 100
 None
 0.92A 2vdvF-2j8kA:
undetectable		 2vdvF-2j8kA:
24.22
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.
2n0s FE-HYDROGENASE

(Chlamydomonas
reinhardtii) 		PF02256
(Fe_hyd_SSU)
PF02906
(Fe_hyd_lg_C) 		5 GLY A 383
GLY A 385
ASN A 350
ALA A 379
THR A 214
 None
 1.20A 2vdvF-2n0sA:
undetectable		 2vdvF-2n0sA:
20.18
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.
2oaa R.MVAI

(Kocuria varians) 		PF15515
(MvaI_BcnI) 		5 GLY A  30
ARG A  25
PHE A  35
ASP A  37
THR A  58
 None
 1.13A 2vdvF-2oaaA:
undetectable		 2vdvF-2oaaA:
21.01
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pt6 SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 124
GLY A 126
GLU A 147
ILE A 148
ALA A 179
 S4M  A 501 (-3.4A)
S4M  A 501 ( 4.4A)
S4M  A 501 (-2.7A)
S4M  A 501 (-3.9A)
S4M  A 501 (-3.5A)
 0.54A 2vdvF-2pt6A:
3.8		 2vdvF-2pt6A:
20.61
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.
2qt3 N-ISOPROPYLAMMELIDE
ISOPROPYL
AMIDOHYDROLASE

(Pseudomonas sp.
ADP) 		PF01979
(Amidohydro_1) 		5 GLY A 347
GLY A 299
ILE A 343
ASP A  58
THR A 246
 None
 0.94A 2vdvF-2qt3A:
undetectable		 2vdvF-2qt3A:
19.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rd5 ACETYLGLUTAMATE
KINASE-LIKE PROTEIN

(Arabidopsis
thaliana) 		PF00696
(AA_kinase) 		5 GLY A  75
GLY A  43
ASN A 117
ALA A 180
ASP A  79
 NLG  A2001 (-3.2A)
None
None
None
None
 1.27A 2vdvF-2rd5A:
3.3		 2vdvF-2rd5A:
22.11
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
2vdv TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Saccharomyces
cerevisiae) 		PF02390
(Methyltransf_4) 		11 GLY E 103
GLY E 105
GLU E 126
ILE E 127
ARG E 128
ASN E 161
ALA E 162
PHE E 182
ASP E 184
THR E 259
GLU E 261
 SAM  E1287 (-3.1A)
SAM  E1287 (-3.6A)
SAM  E1287 (-2.6A)
SAM  E1287 (-3.8A)
SAM  E1287 (-4.9A)
SAM  E1287 (-3.4A)
SAM  E1287 (-3.9A)
SAM  E1287 (-4.6A)
SAM  E1287 (-4.0A)
SAM  E1287 (-2.8A)
SAM  E1287 (-2.9A)
 0.00A 2vdvF-2vdvE:
40.0		 2vdvF-2vdvE:
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.
2ygl BLOOD GROUP A-AND
B-CLEAVING
ENDO-BETA-GALACTOSID
ASE

(Streptococcus
pneumoniae) 		PF08305
(NPCBM) 		5 GLY A 121
GLY A 119
ASN A  97
ASP A 149
THR A 144
 None
 1.21A 2vdvF-2yglA:
undetectable		 2vdvF-2yglA:
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.
2ywd GLUTAMINE
AMIDOTRANSFERASE
SUBUNIT PDXT

(Thermus
thermophilus) 		PF01174
(SNO) 		5 GLU A  19
ARG A  15
ALA A  28
ASP A  13
THR A 176
 None
 1.20A 2vdvF-2ywdA:
undetectable		 2vdvF-2ywdA:
19.37
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.
3b8k DIHYDROLIPOYLLYSINE-
RESIDUE
ACETYLTRANSFERASE

(Homo sapiens) 		PF00198
(2-oxoacid_dh) 		5 GLY A 323
GLY A 325
ILE A 342
ARG A 343
ASN A 341
 None
 1.16A 2vdvF-3b8kA:
undetectable		 2vdvF-3b8kA:
19.92
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ckk TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Homo sapiens) 		PF02390
(Methyltransf_4) 		5 GLY A  54
ARG A  79
ALA A 111
PHE A 131
GLU A 210
 GOL  A 302 ( 3.3A)
SAM  A 301 (-3.8A)
SAM  A 301 (-3.7A)
SAM  A 301 (-4.8A)
SAM  A 301 (-4.1A)
 1.25A 2vdvF-3ckkA:
29.6		 2vdvF-3ckkA:
53.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ckk TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Homo sapiens) 		PF02390
(Methyltransf_4) 		7 GLY A  54
GLU A  77
ILE A  78
ARG A  79
ASN A 110
ALA A 111
PHE A 131
 GOL  A 302 ( 3.3A)
SAM  A 301 (-2.7A)
SAM  A 301 (-3.8A)
SAM  A 301 (-3.8A)
SAM  A 301 (-3.5A)
SAM  A 301 (-3.7A)
SAM  A 301 (-4.8A)
 0.91A 2vdvF-3ckkA:
29.6		 2vdvF-3ckkA:
53.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ckk TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Homo sapiens) 		PF02390
(Methyltransf_4) 		7 GLY A  54
GLU A  77
ILE A  78
ARG A  79
ASN A 110
PHE A 131
ASP A 133
 GOL  A 302 ( 3.3A)
SAM  A 301 (-2.7A)
SAM  A 301 (-3.8A)
SAM  A 301 (-3.8A)
SAM  A 301 (-3.5A)
SAM  A 301 (-4.8A)
GOL  A 302 ( 3.6A)
 1.12A 2vdvF-3ckkA:
29.6		 2vdvF-3ckkA:
53.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ckk TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Homo sapiens) 		PF02390
(Methyltransf_4) 		6 GLY A  54
GLY A  56
ALA A 111
PHE A 131
THR A 208
GLU A 210
 GOL  A 302 ( 3.3A)
SAM  A 301 (-3.5A)
SAM  A 301 (-3.7A)
SAM  A 301 (-4.8A)
SAM  A 301 (-2.8A)
SAM  A 301 (-4.1A)
 0.83A 2vdvF-3ckkA:
29.6		 2vdvF-3ckkA:
53.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ckk TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Homo sapiens) 		PF02390
(Methyltransf_4) 		8 GLY A  54
GLY A  56
GLU A  77
ILE A  78
ASN A 110
ALA A 111
PHE A 131
THR A 208
 GOL  A 302 ( 3.3A)
SAM  A 301 (-3.5A)
SAM  A 301 (-2.7A)
SAM  A 301 (-3.8A)
SAM  A 301 (-3.5A)
SAM  A 301 (-3.7A)
SAM  A 301 (-4.8A)
SAM  A 301 (-2.8A)
 0.35A 2vdvF-3ckkA:
29.6		 2vdvF-3ckkA:
53.73
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ckk TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Homo sapiens) 		PF02390
(Methyltransf_4) 		8 GLY A  54
GLY A  56
GLU A  77
ILE A  78
ASN A 110
PHE A 131
ASP A 133
THR A 208
 GOL  A 302 ( 3.3A)
SAM  A 301 (-3.5A)
SAM  A 301 (-2.7A)
SAM  A 301 (-3.8A)
SAM  A 301 (-3.5A)
SAM  A 301 (-4.8A)
GOL  A 302 ( 3.6A)
SAM  A 301 (-2.8A)
 0.69A 2vdvF-3ckkA:
29.6		 2vdvF-3ckkA:
53.73
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.
3cs3 SUGAR-BINDING
TRANSCRIPTIONAL
REGULATOR, LACI
FAMILY

(Enterococcus
faecalis) 		PF13377
(Peripla_BP_3) 		5 GLY A 207
GLY A 177
ILE A 205
ALA A 216
GLU A 179
 None
 1.16A 2vdvF-3cs3A:
undetectable		 2vdvF-3cs3A:
23.89
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dli METHYLTRANSFERASE

(Archaeoglobus
fulgidus) 		PF13489
(Methyltransf_23) 		5 GLY A 290
GLY A 292
ILE A 312
ALA A 331
GLU A 259
 None
 1.18A 2vdvF-3dliA:
5.1		 2vdvF-3dliA:
24.18
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.
3dxx TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Escherichia
coli) 		PF02390
(Methyltransf_4) 		5 GLY A  71
GLU A  94
ALA A 122
PHE A 142
ASP A 144
 None
 0.82A 2vdvF-3dxxA:
17.6		 2vdvF-3dxxA:
26.19
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.
3dxx TRNA
(GUANINE-N(7)-)-METH
YLTRANSFERASE

(Escherichia
coli) 		PF02390
(Methyltransf_4) 		5 GLY A  71
GLY A  73
GLU A  94
ALA A 122
PHE A 142
 None
 0.47A 2vdvF-3dxxA:
17.6		 2vdvF-3dxxA:
26.19
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.
3e05 PRECORRIN-6Y
C5,15-METHYLTRANSFER
ASE
(DECARBOXYLATING)

(Geobacter
metallireducens) 		no annotation 5 GLY A 256
GLY A 258
GLU A 279
ALA A 307
THR A 232
 None
CL  A   1 ( 4.7A)
None
None
None
 0.62A 2vdvF-3e05A:
11.8		 2vdvF-3e05A:
24.25
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.
3fd0 PUTATIVE
CYSTATHIONINE
BETA-LYASE INVOLVED
IN ALUMINUM
RESISTANCE

(Listeria
innocua) 		PF06838
(Met_gamma_lyase) 		5 GLY A 237
GLY A  85
ILE A 225
ALA A 233
THR A  91
 None
LLP  A 226 ( 3.5A)
LLP  A 226 ( 4.3A)
None
None
 1.25A 2vdvF-3fd0A:
undetectable		 2vdvF-3fd0A:
20.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3gvh MALATE DEHYDROGENASE

(Brucella
abortus) 		PF00056
(Ldh_1_N)
PF02866
(Ldh_1_C) 		5 GLY A  15
GLY A  10
ILE A 119
ALA A 236
THR A  39
 None
NAD  A 400 ( 4.1A)
NAD  A 400 (-4.7A)
None
None
 1.04A 2vdvF-3gvhA:
4.9		 2vdvF-3gvhA:
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.
3hjn THYMIDYLATE KINASE

(Thermotoga
maritima) 		PF02223
(Thymidylate_kin) 		5 GLY A  43
GLY A  39
GLU A  44
ARG A  47
GLU A  36
 None
None
None
TYD  A 401 (-2.9A)
None
 1.16A 2vdvF-3hjnA:
undetectable		 2vdvF-3hjnA:
22.13
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3k9d ALDEHYDE
DEHYDROGENASE

(Listeria
monocytogenes) 		PF00171
(Aldedh) 		5 GLY A 403
GLY A 406
ARG A 396
ALA A 224
PHE A 245
 None
 1.26A 2vdvF-3k9dA:
2.7		 2vdvF-3k9dA:
18.88
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.
3lga SAM-DEPENDENT
METHYLTRANSFERASE

(Pyrococcus
abyssi) 		PF08704
(GCD14)
PF14801
(GCD14_N) 		5 GLY A 101
GLY A 103
GLU A 125
ILE A 126
ARG A 127
 SAH  A 301 (-3.1A)
SAH  A 301 (-3.5A)
SAH  A 301 (-2.8A)
SAH  A 301 (-4.1A)
None
 0.90A 2vdvF-3lgaA:
12.0		 2vdvF-3lgaA:
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.
3mgg METHYLTRANSFERASE

(Methanosarcina
mazei) 		PF13847
(Methyltransf_31) 		5 GLY A  43
GLY A  45
ILE A  67
ASN A  93
PHE A 111
 None
 0.66A 2vdvF-3mggA:
12.7		 2vdvF-3mggA:
25.56
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.
3mqt MANDELATE
RACEMASE/MUCONATE
LACTONIZING PROTEIN

(Shewanella
pealeana) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A 257
ILE A 232
ALA A 217
ASP A 206
GLU A 259
 None
None
None
MG  A1243 (-3.3A)
MG  A1243 (-3.0A)
 1.14A 2vdvF-3mqtA:
undetectable		 2vdvF-3mqtA:
20.84
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.
3njr PRECORRIN-6Y
METHYLASE

(Rhodobacter
capsulatus) 		no annotation 5 GLY A  42
GLY A  44
GLU A  63
ALA A  92
THR A  18
 SAH  A 300 (-3.1A)
SAH  A 300 (-3.4A)
SAH  A 300 (-2.6A)
SAH  A 300 (-4.2A)
SAH  A 300 (-3.8A)
 0.69A 2vdvF-3njrA:
10.0		 2vdvF-3njrA:
22.96
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.
3njr PRECORRIN-6Y
METHYLASE

(Rhodobacter
capsulatus) 		no annotation 5 GLY A  42
GLY A  44
GLU A  63
ARG A  65
THR A  18
 SAH  A 300 (-3.1A)
SAH  A 300 (-3.4A)
SAH  A 300 (-2.6A)
None
SAH  A 300 (-3.8A)
 1.01A 2vdvF-3njrA:
10.0		 2vdvF-3njrA:
22.96
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.
3nlc UNCHARACTERIZED
PROTEIN VP0956

(Vibrio
parahaemolyticus) 		no annotation 5 GLY A 160
GLY A 157
GLU A 127
ARG A 128
THR A 139
 FAD  A 601 (-3.4A)
FAD  A 601 (-4.1A)
FAD  A 601 (-2.6A)
FAD  A 601 (-4.4A)
None
 1.16A 2vdvF-3nlcA:
2.8		 2vdvF-3nlcA:
17.79
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.
3plr UDP-GLUCOSE
6-DEHYDROGENASE

(Klebsiella
pneumoniae) 		PF00984
(UDPG_MGDP_dh)
PF03720
(UDPG_MGDP_dh_C)
PF03721
(UDPG_MGDP_dh_N) 		5 GLY A  16
GLY A  12
ILE A   3
ALA A  20
GLU A 141
 None
 1.06A 2vdvF-3plrA:
5.2		 2vdvF-3plrA:
19.51
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.
3qv2 5-CYTOSINE DNA
METHYLTRANSFERASE

(Entamoeba
histolytica) 		PF00145
(DNA_methylase) 		5 GLY A  16
GLU A  10
ASN A  43
ALA A  42
GLU A  23
 SAH  A 323 ( 4.7A)
None
None
SAH  A 323 ( 4.8A)
None
 1.28A 2vdvF-3qv2A:
7.0		 2vdvF-3qv2A:
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.
3sm3 SAM-DEPENDENT
METHYLTRANSFERASES

(Methanosarcina
mazei) 		PF08241
(Methyltransf_11) 		5 GLY A  38
GLY A  40
ILE A  60
ASN A  91
ALA A  92
 None
 0.70A 2vdvF-3sm3A:
5.5		 2vdvF-3sm3A:
26.09
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.
3ss6 ACETYL-COA
ACETYLTRANSFERASE

(Bacillus
anthracis) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 GLY A 288
GLY A 290
ILE A 286
ASN A 162
ALA A 160
 None
 1.10A 2vdvF-3ss6A:
undetectable		 2vdvF-3ss6A:
19.65
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.
3t4x OXIDOREDUCTASE,
SHORT CHAIN
DEHYDROGENASE/REDUCT
ASE FAMILY

(Bacillus
anthracis) 		PF00106
(adh_short) 		5 GLY A  14
GLY A  38
ARG A  39
ASN A 113
THR A  47
 None
 1.22A 2vdvF-3t4xA:
6.3		 2vdvF-3t4xA:
20.22
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.
4b6c DNA GYRASE SUBUNIT B

(Mycolicibacterium
smegmatis) 		PF02518
(HATPase_c) 		5 GLY A  81
GLY A 168
ARG A  78
ALA A  57
GLU A 166
 NA  A1257 (-3.9A)
None
None
None
None
 1.17A 2vdvF-4b6cA:
undetectable		 2vdvF-4b6cA:
21.09
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.
4c2k 3-KETOACYL-COA
THIOLASE,
MITOCHONDRIAL

(Homo sapiens) 		PF00108
(Thiolase_N)
PF02803
(Thiolase_C) 		5 GLY A 117
GLY A 258
ALA A  70
PHE A  96
THR A 362
 None
 1.23A 2vdvF-4c2kA:
undetectable		 2vdvF-4c2kA:
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.
4cr6 N-ACYLMANNOSAMINE
1-DEHYDROGENASE

(Flavobacterium
sp. 141-8) 		PF13561
(adh_short_C2) 		5 GLY A  22
GLY A  25
ILE A 151
ALA A  93
THR A  54
 None
 1.22A 2vdvF-4cr6A:
5.2		 2vdvF-4cr6A:
20.70
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.
4hgz CCBJ

(Streptomyces
caelestis) 		PF13649
(Methyltransf_25) 		5 GLY A  50
GLY A  52
GLU A  71
ASN A  99
PHE A 117
 None
 1.16A 2vdvF-4hgzA:
9.8		 2vdvF-4hgzA:
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.
4il2 STARVATION SENSING
PROTEIN RSPA

(Escherichia
coli) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 GLY A 326
ALA A 156
ASP A 223
THR A 298
GLU A 275
 None
None
MG  A 501 (-2.4A)
None
MG  A 501 (-2.6A)
 1.21A 2vdvF-4il2A:
undetectable		 2vdvF-4il2A:
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.
4jos ADENOSYLHOMOCYSTEINE
NUCLEOSIDASE

(Francisella
philomiragia) 		PF01048
(PNP_UDP_1) 		5 GLY A   8
GLY A  76
GLU A  13
ALA A  47
GLU A 171
 None
 1.15A 2vdvF-4josA:
undetectable		 2vdvF-4josA:
21.98
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.
4jwt METHYLTHIOADENOSINE
NUCLEOSIDASE

(Sulfurimonas
denitrificans) 		PF01048
(PNP_UDP_1) 		5 GLY A   7
GLY A  75
GLU A  12
ALA A  46
GLU A 171
 None
 1.13A 2vdvF-4jwtA:
undetectable		 2vdvF-4jwtA:
22.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4m73 METHYLTRANSFERASE
MPPJ

(Streptomyces
hygroscopicus) 		PF13649
(Methyltransf_25) 		5 GLY A 168
GLY A 170
ILE A 195
ALA A 191
GLU A 201
 SAH  A 401 (-3.5A)
None
None
SAH  A 401 (-3.5A)
None
 1.27A 2vdvF-4m73A:
10.7		 2vdvF-4m73A:
18.21
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.
4mrp ABC TRANSPORTER
RELATED PROTEIN

(Novosphingobium
aromaticivorans) 		PF00005
(ABC_tran)
PF00664
(ABC_membrane) 		5 GLY A 492
GLY A 495
ARG A 494
THR A 489
GLU A 490
 None
 1.11A 2vdvF-4mrpA:
undetectable		 2vdvF-4mrpA:
17.58
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.
4n7t PHOSPHOPENTOMUTASE

(Streptococcus
mutans) 		PF01676
(Metalloenzyme) 		5 GLY A 341
GLY A  16
GLU A 354
ASN A  28
PHE A 297
 None
 1.16A 2vdvF-4n7tA:
undetectable		 2vdvF-4n7tA:
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.
4ph9 PROSTAGLANDIN G/H
SYNTHASE 2

(Mus musculus) 		PF00008
(EGF)
PF03098
(An_peroxidase) 		5 GLY A 289
ILE A 234
ARG A 334
ALA A 303
GLU A 237
 None
 1.28A 2vdvF-4ph9A:
undetectable		 2vdvF-4ph9A:
17.10
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.
4q05 ESTERASE E25

(uncultured
bacterium) 		PF07859
(Abhydrolase_3) 		5 GLY A 188
GLY A 184
ILE A 147
ALA A 160
THR A 214
 None
 1.12A 2vdvF-4q05A:
undetectable		 2vdvF-4q05A:
19.23
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4q2e PHOSPHATIDATE
CYTIDYLYLTRANSFERASE

(Thermotoga
maritima) 		PF01148
(CTP_transf_1) 		5 GLY A 195
GLY A 191
ALA A 228
PHE A 169
ASP A 164
 None
None
None
None
MG  A 304 (-3.9A)
 1.16A 2vdvF-4q2eA:
undetectable		 2vdvF-4q2eA:
21.63
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.
4rya ABC TRANSPORTER
SUBSTRATE BINDING
PROTEIN (SORBITOL)

(Agrobacterium
vitis) 		PF01547
(SBP_bac_1) 		5 GLY A 397
ILE A 193
ASN A 192
ALA A 187
GLU A 430
 None
 1.27A 2vdvF-4ryaA:
undetectable		 2vdvF-4ryaA:
18.27
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.
4u2n ZINC FINGER AND BTB
DOMAIN-CONTAINING
PROTEIN 17,NUCLEUS
ACCUMBENS-ASSOCIATED
PROTEIN 1

(Homo sapiens) 		PF00651
(BTB) 		5 GLY A  69
GLY A  71
ILE A  64
ALA A  94
ASP A  31
 None
 1.23A 2vdvF-4u2nA:
undetectable		 2vdvF-4u2nA:
21.25
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.
4uoe SPERMIDINE SYNTHASE

(Plasmodium
falciparum) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		5 GLY A 124
GLY A 126
GLU A 147
ILE A 148
ALA A 179
 MTA  A 401 (-3.5A)
MTA  A 401 ( 4.5A)
MTA  A 401 (-2.7A)
MTA  A 401 (-3.8A)
MTA  A 401 (-3.6A)
 0.55A 2vdvF-4uoeA:
3.1		 2vdvF-4uoeA:
21.18
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.
4uzs BETA-GALACTOSIDASE

(Bifidobacterium
bifidum) 		PF02449
(Glyco_hydro_42)
PF08532
(Glyco_hydro_42M)
PF08533
(Glyco_hydro_42C) 		5 GLY A 163
GLU A 123
ARG A 122
PHE A 263
THR A 261
 None
None
GOL  A 702 (-2.8A)
None
None
 1.28A 2vdvF-4uzsA:
undetectable		 2vdvF-4uzsA:
15.38
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.
4wgk NEUTRAL CERAMIDASE

(Homo sapiens) 		PF04734
(Ceramidase_alk)
PF17048
(Ceramidse_alk_C) 		5 GLY A 388
GLY A 390
ILE A 357
ALA A 386
PHE A 394
 None
 1.27A 2vdvF-4wgkA:
undetectable		 2vdvF-4wgkA:
15.57
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.
4yjf D-AMINO-ACID OXIDASE

(Sus scrofa) 		PF01266
(DAO) 		5 GLY B  12
GLY B   7
ILE B 179
ALA B 323
THR B  43
 None
FAD  B 401 (-3.3A)
None
None
FAD  B 401 (-3.9A)
 1.27A 2vdvF-4yjfB:
3.2		 2vdvF-4yjfB:
20.59
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.
4yrp HISTIDYL-TRNA
SYNTHETASE

(Trypanosoma
cruzi) 		PF03129
(HGTP_anticodon)
PF13393
(tRNA-synt_His) 		5 GLY A 340
GLY A 359
ILE A 322
ASP A 343
THR A 128
 None
HIS  A 501 (-3.5A)
None
None
HIS  A 501 (-3.7A)
 1.24A 2vdvF-4yrpA:
undetectable		 2vdvF-4yrpA:
17.66
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.
4zpx ATP-DEPENDENT
PROTEASE LON

(Thermococcus
onnurineus) 		PF01078
(Mg_chelatase)
PF13654
(AAA_32) 		5 GLY A 296
GLU A 246
ASP A 299
THR A  71
GLU A  68
 None
 0.96A 2vdvF-4zpxA:
undetectable		 2vdvF-4zpxA:
19.29
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.
5aid MEP2

(Candida
albicans) 		PF00909
(Ammonium_transp) 		5 GLY A 345
GLY A 349
ILE A 319
ALA A 323
THR A 298
 None
 1.28A 2vdvF-5aidA:
undetectable		 2vdvF-5aidA:
19.07
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.
5but KTR SYSTEM POTASSIUM
UPTAKE PROTEIN A,KTR
SYSTEM POTASSIUM
UPTAKE PROTEIN A

(Bacillus
subtilis) 		PF02254
(TrkA_N) 		5 GLY A  13
GLY A  15
ILE A  37
ASN A  56
ALA A  57
 None
 1.15A 2vdvF-5butA:
6.1		 2vdvF-5butA:
20.27
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.
5but KTR SYSTEM POTASSIUM
UPTAKE PROTEIN A,KTR
SYSTEM POTASSIUM
UPTAKE PROTEIN A

(Bacillus
subtilis) 		PF02254
(TrkA_N) 		5 GLY A 155
GLY A 157
ILE A 179
ASN A 198
ALA A 199
 None
 1.14A 2vdvF-5butA:
6.1		 2vdvF-5butA:
20.27
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.
5ce6 FACT-SPT16

(Cicer arietinum) 		PF00557
(Peptidase_M24)
PF14826
(FACT-Spt16_Nlob) 		5 GLY A 379
GLY A 377
GLU A 384
ALA A  71
THR A 431
 None
None
None
ACT  A 501 (-3.8A)
None
 1.27A 2vdvF-5ce6A:
undetectable		 2vdvF-5ce6A:
19.50
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.
5djs TETRATRICOPEPTIDE
TPR_2 REPEAT PROTEIN

(Thermobaculum
terrenum) 		PF13181
(TPR_8)
PF13844
(Glyco_transf_41) 		5 GLY A 476
GLY A 474
ILE A 353
ALA A 360
THR A 481
 None
 1.25A 2vdvF-5djsA:
4.9		 2vdvF-5djsA:
18.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ey5 LBCA-B

(synthetic
construct) 		PF00291
(PALP) 		5 GLY B 113
ILE B  85
ASN B  78
ALA B  82
GLU B 106
 None
None
None
PLP  B 501 ( 3.1A)
None
 1.17A 2vdvF-5ey5B:
undetectable		 2vdvF-5ey5B:
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.
5fad RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE,
PUTATIVE

(Sulfolobus
islandicus) 		PF13847
(Methyltransf_31) 		6 GLY A  36
GLY A  38
GLU A  59
ILE A  60
ASN A  87
PHE A 102
 SAH  A 201 (-3.0A)
SAH  A 201 (-3.5A)
SAH  A 201 (-2.9A)
SAH  A 201 (-3.8A)
SAH  A 201 (-3.7A)
SAH  A 201 (-4.9A)
 0.95A 2vdvF-5fadA:
9.5		 2vdvF-5fadA:
22.63
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.
5fbh EXTRACELLULAR
CALCIUM-SENSING
RECEPTOR

(Homo sapiens) 		no annotation 5 GLY B 143
GLY B  36
ASN B 419
ALA B 168
THR B 111
 None
None
None
TCR  B 609 (-4.1A)
None
 1.20A 2vdvF-5fbhB:
undetectable		 2vdvF-5fbhB:
17.64
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.
5gyr CYTOCHROME C'

(Allochromatium
vinosum) 		PF01322
(Cytochrom_C_2) 		5 GLY A  24
GLY A  20
ASN A  29
ALA A  28
GLU A  17
 None
 1.27A 2vdvF-5gyrA:
undetectable		 2vdvF-5gyrA:
16.13
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.
5h5b THYMIDYLATE KINASE

(Aquifex
aeolicus) 		no annotation 5 GLY B  43
GLY B  39
GLU B  44
ARG B  47
GLU B  36
 None
 1.19A 2vdvF-5h5bB:
undetectable		 2vdvF-5h5bB:
23.08
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.
5h5z MHC CLASS I ANTIGEN

(Ctenopharyngodon
idella) 		no annotation 5 GLY A  98
GLY A 109
ASN A  95
THR A 107
GLU A 158
 None
 1.25A 2vdvF-5h5zA:
undetectable		 2vdvF-5h5zA:
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.
5hr4 MMEI

(Methylophilus
methylotrophus) 		no annotation 6 GLY C 365
GLU C 413
ILE C 414
ASN C 460
ALA C 461
THR C 316
 SFG  C1002 (-3.4A)
SFG  C1002 (-2.8A)
SFG  C1002 (-3.9A)
SFG  C1002 (-3.2A)
SFG  C1002 (-3.8A)
SFG  C1002 (-4.0A)
 0.87A 2vdvF-5hr4C:
7.1		 2vdvF-5hr4C:
14.18
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.
5iv8 LPS BIOSYNTHESIS
PROTEIN

(Klebsiella
pneumoniae) 		PF04453
(OstA_C) 		5 GLY A 576
ILE A 622
ALA A 632
ASP A 532
THR A 555
 None
 1.24A 2vdvF-5iv8A:
undetectable		 2vdvF-5iv8A:
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.
5iv9 LPS-ASSEMBLY PROTEIN
LPTD

(Klebsiella
pneumoniae) 		PF03968
(OstA)
PF04453
(OstA_C) 		5 GLY A 553
ILE A 599
ALA A 609
ASP A 509
THR A 532
 None
 1.12A 2vdvF-5iv9A:
undetectable		 2vdvF-5iv9A:
14.44
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.
5jnq PHOSPHO-N-ACETYLMURA
MOYL-PENTAPEPTIDE-TR
ANSFERASE

([Clostridium]
bolteae) 		PF00953
(Glycos_transf_4)
PF10555
(MraY_sig1) 		5 GLY A 212
ILE A  10
ALA A   8
PHE A 217
THR A 182
 None
 1.08A 2vdvF-5jnqA:
undetectable		 2vdvF-5jnqA:
18.75
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.
5koh NITROGENASE FEMO
BETA SUBUNIT PROTEIN
NIFK

(Gluconacetobacter
diazotrophicus) 		PF00148
(Oxidored_nitro)
PF11844
(DUF3364) 		5 GLY B 224
ASN B 232
ALA B 229
ASP B 369
THR B 297
 None
 1.20A 2vdvF-5kohB:
4.2		 2vdvF-5kohB:
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.
5lew DNA POLYMERASE III
SUBUNIT ALPHA

(Mycobacterium
tuberculosis) 		no annotation 5 GLY A 381
GLY A 379
ILE A 396
ALA A 386
ASP A 423
 None
 1.27A 2vdvF-5lewA:
undetectable		 2vdvF-5lewA:
13.97
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.
5m99 ALPHA-AMYLASE

(Thermotoga
petrophila) 		PF00128
(Alpha-amylase) 		5 GLY B  49
GLY B  47
ASN B  52
ASP B  94
THR B 389
 NA  B 602 ( 4.8A)
None
None
None
None
 1.12A 2vdvF-5m99B:
undetectable		 2vdvF-5m99B:
17.13
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.
5mqm GLYCOSYL HYDROLASES
FAMILY 2, SUGAR
BINDING DOMAIN

(Bacteroides
thetaiotaomicron) 		PF17132
(Glyco_hydro_106) 		5 GLY A 600
GLY A 645
ARG A 599
ASN A 565
THR A1076
 None
 1.26A 2vdvF-5mqmA:
undetectable		 2vdvF-5mqmA:
11.56
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.
5ocm NAD_GLY3P_DH,
NAD-DEPENDENT
GLYCEROL-3-PHOSPHATE
DEHYDROGENASE

(Streptosporangium
roseum) 		no annotation 5 GLY A 153
ALA A  21
PHE A 132
ASP A 130
THR A 157
 None
 1.12A 2vdvF-5ocmA:
5.8		 2vdvF-5ocmA:
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.
5ol2 ELECTRON TRANSFER
FLAVOPROTEIN SMALL
SUBUNIT
ACYL-COA
DEHYDROGENASE

(Clostridioides
difficile;
Clostridioides
difficile) 		no annotation
no annotation 		5 GLY B 194
ILE C  52
ALA C 114
ASP C  64
GLU B 201
 None
 1.26A 2vdvF-5ol2B:
undetectable		 2vdvF-5ol2B:
20.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5tul TETRACYCLINE
DESTRUCTASE TET(55)

(uncultured
bacterium) 		PF01494
(FAD_binding_3) 		5 GLY A  16
ILE A 153
ALA A 309
THR A  39
GLU A  34
 None
 1.25A 2vdvF-5tulA:
2.2		 2vdvF-5tulA:
22.54
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5uto EDD DOMAIN PROTEIN,
DEGV FAMILY

(Staphylococcus
aureus) 		no annotation 5 GLY A 235
GLU A 262
ILE A  46
ALA A 268
GLU A 239
 None
 0.99A 2vdvF-5utoA:
undetectable		 2vdvF-5utoA:
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.
5xj6 GLYCEROL-3-PHOSPHATE
ACYLTRANSFERASE

(Aquifex
aeolicus) 		no annotation 5 GLY A  63
GLY A 111
ALA A  10
PHE A  57
ASP A  59
 None
None
None
None
PO4  A 306 ( 4.6A)
 1.27A 2vdvF-5xj6A:
undetectable		 2vdvF-5xj6A:
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.
6cvz E3 UBIQUITIN-PROTEIN
LIGASE RFWD3

(Homo sapiens) 		no annotation 5 GLY A 558
GLY A 562
ARG A 540
ALA A 516
GLU A 578
 None
 1.23A 2vdvF-6cvzA:
undetectable		 2vdvF-6cvzA:
undetectable