SIMILAR PATTERNS OF AMINO ACIDS FOR 3A27_A_SAMA250

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.
1bqg D-GLUCARATE
DEHYDRATASE

(Pseudomonas
putida) 		PF02746
(MR_MLE_N)
PF13378
(MR_MLE_C) 		5 ASN A 185
PHE A  42
GLY A  39
TYR A 170
PHE A 350
 None
 1.46A 3a27A-1bqgA:
0.8		 3a27A-1bqgA:
19.06
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.
1ex0 COAGULATION FACTOR
XIII A CHAIN

(Homo sapiens) 		PF00868
(Transglut_N)
PF00927
(Transglut_C)
PF01841
(Transglut_core) 		5 ASN A 337
GLY A 215
TYR A 338
TYR A 560
PHE A 559
 None
 1.40A 3a27A-1ex0A:
undetectable		 3a27A-1ex0A:
16.62
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.
1k32 TRICORN PROTEASE

(Thermoplasma
acidophilum) 		PF03572
(Peptidase_S41)
PF07676
(PD40)
PF14684
(Tricorn_C1)
PF14685
(Tricorn_PDZ) 		5 SER A 762
ARG A 120
GLY A 169
ASN A 171
TYR A 163
 None
 1.46A 3a27A-1k32A:
0.0		 3a27A-1k32A:
14.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1w07 ACYL-COA OXIDASE

(Arabidopsis
thaliana) 		PF01756
(ACOX)
PF02770
(Acyl-CoA_dh_M)
PF14749
(Acyl-CoA_ox_N) 		5 SER A  51
ASN A  52
ARG A  55
GLY A 232
ASP A 238
 None
 1.24A 3a27A-1w07A:
undetectable		 3a27A-1w07A:
18.38
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.
1wno CHITINASE

(Aspergillus
fumigatus) 		PF00704
(Glyco_hydro_18) 		5 SER A 309
ASN A 225
ASP A 242
ARG A 245
TYR A 334
 None
NDG  A1042 (-2.4A)
None
None
None
 1.36A 3a27A-1wnoA:
undetectable		 3a27A-1wnoA:
20.05
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.
1ztv HYPOTHETICAL PROTEIN

(Enterococcus
faecalis) 		PF01904
(DUF72) 		5 ASN A 218
PHE A 193
GLY A 195
TYR A 215
PHE A 191
 None
 1.22A 3a27A-1ztvA:
undetectable		 3a27A-1ztvA:
23.48
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.
2hor ALLIIN LYASE 1

(Allium sativum) 		PF04863
(EGF_alliinase)
PF04864
(Alliinase_C) 		5 SER A  63
GLY A 390
ASP A 373
ARG A 338
PHE A 339
 None
 1.46A 3a27A-2horA:
undetectable		 3a27A-2horA:
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.
2iny HEXON PROTEIN

(Fowl
aviadenovirus A) 		PF01065
(Adeno_hexon)
PF03678
(Adeno_hexon_C) 		5 SER A 441
TYR A 446
ASN A 509
ARG A 113
PHE A 117
 None
 1.42A 3a27A-2inyA:
undetectable		 3a27A-2inyA:
12.79
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.
2ojh UNCHARACTERIZED
PROTEIN
ATU1656/AGR_C_3050

(Agrobacterium
fabrum) 		PF07676
(PD40) 		5 SER A 213
ARG A 209
GLY A 256
ASN A 258
ASP A 227
 None
 1.23A 3a27A-2ojhA:
undetectable		 3a27A-2ojhA:
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.
2plc PHOSPHATIDYLINOSITOL
-SPECIFIC
PHOSPHOLIPASE C

(Listeria
monocytogenes) 		PF00388
(PI-PLC-X) 		5 ASN A 230
GLY A 273
ASN A 235
ARG A 124
PHE A 195
 None
 1.13A 3a27A-2plcA:
undetectable		 3a27A-2plcA:
22.05
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.
2vp1 PERIPLASMIC
IRON-BINDING PROTEIN

(Synechocystis
sp. PCC 6803) 		PF13343
(SBP_bac_6) 		5 PHE A 281
GLY A  55
ASP A  47
ARG A  42
PHE A  84
 None
 1.06A 3a27A-2vp1A:
undetectable		 3a27A-2vp1A:
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.
2wd6 AGGLUTININ RECEPTOR

(Streptococcus
gordonii) 		PF06696
(Strep_SA_rep)
PF08363
(GbpC) 		5 SER A 688
GLY A 724
TYR A 673
ASN A 645
PHE A 629
 None
 1.33A 3a27A-2wd6A:
undetectable		 3a27A-2wd6A:
18.89
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.
2yw2 PHOSPHORIBOSYLAMINE-
-GLYCINE LIGASE

(Aquifex
aeolicus) 		PF01071
(GARS_A)
PF02843
(GARS_C)
PF02844
(GARS_N) 		5 SER A 232
PHE A 267
GLY A 289
ASN A 285
PHE A  90
 None
 1.45A 3a27A-2yw2A:
4.1		 3a27A-2yw2A:
23.97
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3a27 UNCHARACTERIZED
PROTEIN MJ1557

(Methanocaldococcus
jannaschii) 		PF02475
(Met_10) 		12 SER A  80
ASN A  83
ARG A  87
PHE A 104
GLY A 106
TYR A 109
LYS A 128
ASN A 129
ASP A 154
ARG A 156
TYR A 171
PHE A 178
 SAM  A 250 (-4.3A)
SAM  A 250 (-3.8A)
SAM  A 250 (-4.7A)
SAM  A 250 (-4.7A)
SAM  A 250 (-3.6A)
SAM  A 250 (-3.6A)
SAM  A 250 (-3.5A)
None
SAM  A 250 (-3.2A)
SAM  A 250 ( 4.7A)
SAM  A 250 (-4.1A)
SAM  A 250 (-4.6A)
 0.00A 3a27A-3a27A:
40.6		 3a27A-3a27A:
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.
3anw PUTATIVE
UNCHARACTERIZED
PROTEIN

(Thermococcus
kodakarensis) 		no annotation 5 ARG A 178
GLY A 172
LYS A 136
ARG A 102
TYR A 156
 None
 1.28A 3a27A-3anwA:
undetectable		 3a27A-3anwA:
20.71
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ay0 UNCHARACTERIZED
PROTEIN MJ0883

(Methanocaldococcus
jannaschii) 		PF02475
(Met_10) 		5 PHE A 203
GLY A 205
ASN A 225
ASP A 251
PHE A 273
 ADN  A 401 (-4.9A)
ADN  A 401 ( 4.0A)
ADN  A 401 (-4.9A)
ADN  A 401 (-3.8A)
ADN  A 401 (-4.6A)
 0.54A 3a27A-3ay0A:
26.2		 3a27A-3ay0A:
31.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ay0 UNCHARACTERIZED
PROTEIN MJ0883

(Methanocaldococcus
jannaschii) 		PF02475
(Met_10) 		5 PHE A 203
GLY A 205
ASP A 251
ARG A 253
PHE A 273
 ADN  A 401 (-4.9A)
ADN  A 401 ( 4.0A)
ADN  A 401 (-3.8A)
None
ADN  A 401 (-4.6A)
 0.90A 3a27A-3ay0A:
26.2		 3a27A-3ay0A:
31.53
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.
3bma D-ALANYL-LIPOTEICHOI
C ACID SYNTHETASE

(Streptococcus
pneumoniae) 		PF04914
(DltD) 		5 PHE A  75
GLY A 105
ASN A 113
TYR A 132
PHE A 313
 None
 1.45A 3a27A-3bmaA:
1.1		 3a27A-3bmaA:
18.54
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3k6r PUTATIVE TRANSFERASE
PH0793

(Pyrococcus
horikoshii) 		PF02475
(Met_10) 		6 ARG A 116
PHE A 133
GLY A 135
ARG A 185
TYR A 200
PHE A 207
 None
 0.76A 3a27A-3k6rA:
30.1		 3a27A-3k6rA:
40.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3k6r PUTATIVE TRANSFERASE
PH0793

(Pyrococcus
horikoshii) 		PF02475
(Met_10) 		7 SER A 109
ARG A 116
PHE A 133
GLY A 135
ASP A 183
TYR A 200
PHE A 207
 None
 0.55A 3a27A-3k6rA:
30.1		 3a27A-3k6rA:
40.50
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.
3mcx SUSD SUPERFAMILY
PROTEIN

(Bacteroides
thetaiotaomicron) 		PF07980
(SusD_RagB)
PF14322
(SusD-like_3) 		5 ASN A 103
GLY A  69
TYR A  68
ASP A 316
TYR A  92
 None
 1.48A 3a27A-3mcxA:
undetectable		 3a27A-3mcxA:
18.66
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.
3v8h THYMIDYLATE SYNTHASE

(Burkholderia
thailandensis) 		PF00303
(Thymidylat_synt) 		5 SER A  68
ARG A  73
GLY A  76
ASP A 305
ARG A 283
 None
None
EDO  A 325 ( 4.9A)
None
None
 1.47A 3a27A-3v8hA:
undetectable		 3a27A-3v8hA:
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.
3w2w CRISPR SYSTEM CMR
SUBUNIT CMR3

(Pyrococcus
furiosus) 		PF09700
(Cas_Cmr3) 		5 ARG B  77
TYR B 175
ASP B  10
ARG B 146
PHE B 168
 None
 1.39A 3a27A-3w2wB:
undetectable		 3a27A-3w2wB:
23.10
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.
3zhe NONSENSE-MEDIATED
MRNA DECAY PROTEIN

(Caenorhabditis
elegans) 		no annotation 5 SER A 353
ASN A 357
GLY A 131
ASN A 109
ASP A 114
 None
 1.45A 3a27A-3zheA:
undetectable		 3a27A-3zheA:
21.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4cgt CYCLODEXTRIN
GLYCOSYLTRANSFERASE

(Bacillus
circulans) 		PF00128
(Alpha-amylase)
PF00686
(CBM_20)
PF01833
(TIG)
PF02806
(Alpha-amylase_C) 		5 SER A  13
ASN A 318
GLY A 518
TYR A 406
PHE A 530
 None
 1.42A 3a27A-4cgtA:
undetectable		 3a27A-4cgtA:
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.
4p05 ARYLSULFATE
SULFOTRANSFERASE
ASST

(Escherichia
coli) 		PF05935
(Arylsulfotrans)
PF17425
(Arylsulfotran_N) 		5 GLY A 517
ASN A 436
ASP A 450
ARG A 455
TYR A 497
 None
4NS  A 601 (-3.3A)
None
None
None
 1.42A 3a27A-4p05A:
undetectable		 3a27A-4p05A:
19.58
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.
4qnl TAIL FIBER PROTEIN

(Escherichia
virus G7C) 		no annotation 5 SER A 833
ASN A 831
GLY A 755
TYR A 739
ASN A 761
 None
 1.32A 3a27A-4qnlA:
undetectable		 3a27A-4qnlA:
14.88
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.
4qnl TAIL FIBER PROTEIN

(Escherichia
virus G7C) 		no annotation 5 SER A 833
ASN A 831
GLY A 755
TYR A 739
ASP A 808
 None
 1.06A 3a27A-4qnlA:
undetectable		 3a27A-4qnlA:
14.88
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.
5brq GLYCOSIDE HYDROLASE
FAMILY 13

(Bacillus
licheniformis) 		PF00128
(Alpha-amylase)
PF16657
(Malt_amylase_C) 		5 SER A 245
ASN A 240
GLY A 199
LYS A  97
ASP A  49
 None
 1.28A 3a27A-5brqA:
undetectable		 3a27A-5brqA:
18.84
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.
5d7z LACTOYLGLUTATHIONE
LYASE

(Zea mays) 		PF00903
(Glyoxalase) 		5 PHE A  94
GLY A  91
ASN A 222
TYR A 224
PHE A  97
 None
 1.41A 3a27A-5d7zA:
undetectable		 3a27A-5d7zA:
25.23
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.
5do8 LMO0184 PROTEIN

(Listeria
monocytogenes) 		no annotation 5 SER B 245
ASN B 240
GLY B 193
LYS B  95
ASP B  47
 None
 1.24A 3a27A-5do8B:
undetectable		 3a27A-5do8B:
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.
5gqf LACTO-N-BIOSIDASE

(Bifidobacterium
longum) 		no annotation 5 SER A 567
GLY A 358
ASN A 401
ASP A 458
TYR A 429
 None
 1.26A 3a27A-5gqfA:
undetectable		 3a27A-5gqfA:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gqf LACTO-N-BIOSIDASE

(Bifidobacterium
longum) 		no annotation 5 SER A 567
GLY A 358
TYR A 334
ASN A 401
ASP A 458
 None
 1.19A 3a27A-5gqfA:
undetectable		 3a27A-5gqfA:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5h4e BETA 1-3 GLUCANASE

(Clostridium
beijerinckii) 		no annotation 5 SER A 318
GLY A 339
TYR A 316
ASN A 341
TYR A 292
 None
 1.37A 3a27A-5h4eA:
undetectable		 3a27A-5h4eA:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5je8 3-HYDROXYISOBUTYRATE
DEHYDROGENASE

(Bacillus cereus) 		PF03446
(NAD_binding_2)
PF14833
(NAD_binding_11) 		5 SER A  50
PHE A  82
GLY A  77
TYR A  75
PHE A 116
 None
 1.50A 3a27A-5je8A:
6.6		 3a27A-5je8A:
22.73
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.
5lc5 NADH DEHYDROGENASE
[UBIQUINONE]
IRON-SULFUR PROTEIN
2, MITOCHONDRIAL

(Bos taurus) 		PF00346
(Complex1_49kDa) 		5 SER D 119
ARG D 138
GLY D 142
ARG D 174
PHE D 178
 None
 1.28A 3a27A-5lc5D:
undetectable		 3a27A-5lc5D:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ngk GLUCOSYLCERAMIDASE

(Bacteroides
thetaiotaomicron) 		PF02055
(Glyco_hydro_30)
PF17189
(Glyco_hydro_30C) 		5 SER A 446
ASN A 368
ARG A 432
PHE A 337
GLY A 373
 None
 1.49A 3a27A-5ngkA:
undetectable		 3a27A-5ngkA:
21.49
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.
5svc ACETONE CARBOXYLASE
ALPHA SUBUNIT

(Xanthobacter
autotrophicus) 		PF02538
(Hydantoinase_B) 		5 SER A 186
ASN A 454
PHE A 536
GLY A 538
ASP A 602
 None
 1.47A 3a27A-5svcA:
undetectable		 3a27A-5svcA:
14.67
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.
5svc ACETONE CARBOXYLASE
ALPHA SUBUNIT

(Xanthobacter
autotrophicus) 		PF02538
(Hydantoinase_B) 		5 SER A 398
PHE A 536
GLY A 538
TYR A 399
ASP A 602
 None
 1.49A 3a27A-5svcA:
undetectable		 3a27A-5svcA:
14.67
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.
5wt3 TRNA
(GUANINE(37)-N1)-MET
HYLTRANSFERASE TRM5A

(Pyrococcus
abyssi) 		no annotation 5 ARG A 174
PHE A 191
GLY A 193
ASN A 215
ASP A 243
 None
MTA  A 401 (-4.4A)
MTA  A 401 (-3.6A)
None
MTA  A 401 (-3.3A)
 0.81A 3a27A-5wt3A:
23.7		 3a27A-5wt3A:
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.
5xwy A TYPE VI-A
CRISPR-CAS
RNA-GUIDED RNA
RIBONUCLEASE, CAS13A

(Leptotrichia
buccalis) 		no annotation 5 ASN A1136
GLY A 955
TYR A1096
ASN A 861
PHE A 824
 None
 1.48A 3a27A-5xwyA:
undetectable		 3a27A-5xwyA:
13.93
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5yac TRNA
(GUANINE(37)-N1)-MET
HYLTRANSFERASE TRM5B

(Pyrococcus
abyssi) 		PF02475
(Met_10) 		5 SER A 166
PHE A 190
ASP A 238
ARG A 240
PHE A 260
 None
 0.74A 3a27A-5yacA:
27.0		 3a27A-5yacA:
35.67
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5yac TRNA
(GUANINE(37)-N1)-MET
HYLTRANSFERASE TRM5B

(Pyrococcus
abyssi) 		PF02475
(Met_10) 		6 SER A 166
PHE A 190
GLY A 192
ASN A 213
ASP A 238
PHE A 260
 None
 0.72A 3a27A-5yacA:
27.0		 3a27A-5yacA:
35.67
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.
1a5l UREASE (ALPHA
SUBUNIT)

(Klebsiella
aerogenes) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		3 MET C 364
GLU C 220
ASN C 251
 None
 0.88A 3a27A-1a5lC:
undetectable		 3a27A-1a5lC:
19.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1amy 1,4-ALPHA-D-GLUCAN
GLUCANOHYDROLASE

(Hordeum vulgare) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		3 MET A 296
GLU A 204
ASN A  91
 None
None
CA  A 500 (-3.0A)
 0.96A 3a27A-1amyA:
undetectable		 3a27A-1amyA:
22.91
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.
1dow ALPHA-CATENIN
BETA-CATENIN

(Mus musculus;
Mus musculus) 		PF01044
(Vinculin)
no annotation 		3 MET A 207
GLU A 197
ASN B 121
 None
 0.93A 3a27A-1dowA:
undetectable		 3a27A-1dowA:
23.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1e6v METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT
METHYL-COENZYME M
REDUCTASE I GAMMA
SUBUNIT

(Methanopyrus
kandleri;
Methanopyrus
kandleri) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N)
PF02240
(MCR_gamma) 		3 MET C  63
GLU B 410
ASN B 199
 None
 1.04A 3a27A-1e6vC:
undetectable		 3a27A-1e6vC:
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.
1e6y METHYL-COENZYME M
REDUCTASE I BETA
SUBUNIT
METHYL-COENZYME M
REDUCTASE SUBUNIT
GAMMA

(Methanosarcina
barkeri;
Methanosarcina
barkeri) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N)
PF02240
(MCR_gamma) 		3 MET C3060
GLU B2407
ASN B2195
 None
 0.99A 3a27A-1e6yC:
undetectable		 3a27A-1e6yC:
20.57
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.
1e9y UREASE SUBUNIT BETA

(Helicobacter
pylori) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		3 MET B 366
GLU B 222
ASN B 253
 HAE  B 800 ( 4.6A)
None
None
 0.92A 3a27A-1e9yB:
undetectable		 3a27A-1e9yB:
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.
1g01 ENDOGLUCANASE

(Bacillus sp.
KSM-635) 		PF00150
(Cellulase)
PF03424
(CBM_17_28) 		3 MET A 290
GLU A 369
ASN A 417
 None
 1.11A 3a27A-1g01A:
undetectable		 3a27A-1g01A:
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.
1gyt CYTOSOL
AMINOPEPTIDASE

(Escherichia
coli) 		PF00883
(Peptidase_M17)
PF02789
(Peptidase_M17_N) 		3 MET A 290
GLU A 354
ASN A 439
 None
ZN  A 602 (-2.3A)
None
 1.11A 3a27A-1gytA:
undetectable		 3a27A-1gytA:
20.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1gz4 NAD-DEPENDENT MALIC
ENZYME

(Homo sapiens) 		PF00390
(malic)
PF03949
(Malic_M) 		3 MET A 177
GLU A  90
ASN A  31
 None
 0.93A 3a27A-1gz4A:
3.9		 3a27A-1gz4A:
18.41
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.
1hp1 5'-NUCLEOTIDASE

(Escherichia
coli) 		PF00149
(Metallophos)
PF02872
(5_nucleotid_C) 		3 MET A 104
GLU A 118
ASN A 116
 None
None
CO3  A 602 ( 2.6A)
 1.08A 3a27A-1hp1A:
undetectable		 3a27A-1hp1A:
21.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1inl SPERMIDINE SYNTHASE

(Thermotoga
maritima) 		PF01564
(Spermine_synth)
PF17284
(Spermine_synt_N) 		3 MET A  67
GLU A 121
ASN A 152
 None
 0.63A 3a27A-1inlA:
7.1		 3a27A-1inlA:
23.26
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.
1lnl HEMOCYANIN

(Rapana venosa) 		PF00264
(Tyrosinase)
PF14830
(Haemocyan_bet_s) 		3 MET A 242
GLU A 174
ASN A 182
 None
 1.01A 3a27A-1lnlA:
undetectable		 3a27A-1lnlA:
20.33
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lrz FACTOR ESSENTIAL FOR
EXPRESSION OF
METHICILLIN
RESISTANCE

(Staphylococcus
aureus) 		PF02388
(FemAB) 		3 MET A  18
GLU A  51
ASN A  48
 None
 1.02A 3a27A-1lrzA:
undetectable		 3a27A-1lrzA:
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.
1tzs CATHEPSIN E

(Homo sapiens) 		PF00026
(Asp) 		3 MET A 166
GLU A  24
ASN A  19
 None
 1.08A 3a27A-1tzsA:
undetectable		 3a27A-1tzsA:
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.
1u7h ORNITHINE
CYCLODEAMINASE

(Pseudomonas
putida) 		PF02423
(OCD_Mu_crystall) 		3 MET A  58
GLU A 248
ASN A 223
 None
 0.89A 3a27A-1u7hA:
6.0		 3a27A-1u7hA:
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.
1vdk FUMARATE HYDRATASE
CLASS II

(Thermus
thermophilus) 		PF00206
(Lyase_1)
PF10415
(FumaraseC_C) 		3 MET A 365
GLU A 273
ASN A 263
 None
 0.97A 3a27A-1vdkA:
undetectable		 3a27A-1vdkA:
21.53
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.
1vmk PURINE NUCLEOSIDE
PHOSPHORYLASE

(Thermotoga
maritima) 		PF01048
(PNP_UDP_1) 		3 MET A 134
GLU A 186
ASN A 228
 None
GUN  A 300 (-2.7A)
GUN  A 300 (-3.3A)
 1.08A 3a27A-1vmkA:
undetectable		 3a27A-1vmkA:
23.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1wql IRON-SULFUR PROTEIN
LARGE SUBUNIT OF
CUMENE DIOXYGENASE
ETHYLBENZENE
DIOXYGENASE SMALL
SUBUNIT

(Pseudomonas
fluorescens;
Pseudomonas
fluorescens) 		PF00355
(Rieske)
PF00848
(Ring_hydroxyl_A)
PF00866
(Ring_hydroxyl_B) 		3 MET A 106
GLU A 109
ASN B  66
 None
 1.08A 3a27A-1wqlA:
undetectable		 3a27A-1wqlA:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1xkn PUTATIVE
PEPTIDYL-ARGININE
DEIMINASE

(Chlorobaculum
tepidum) 		PF04371
(PAD_porph) 		3 MET A   8
GLU A  11
ASN A 288
 None
 1.09A 3a27A-1xknA:
undetectable		 3a27A-1xknA:
20.89
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.
1yqq XANTHOSINE
PHOSPHORYLASE

(Escherichia
coli) 		PF01048
(PNP_UDP_1) 		3 MET A 140
GLU A 197
ASN A 239
 None
GUN  A 400 (-2.8A)
GUN  A 400 (-3.2A)
 1.08A 3a27A-1yqqA:
undetectable		 3a27A-1yqqA:
22.29
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.
2cn3 BETA-1,4-XYLOGLUCAN
HYDROLASE

(Ruminiclostridium
thermocellum) 		PF02012
(BNR) 		3 MET A 411
GLU A 459
ASN A 749
 BGC  A1764 (-3.6A)
GLC  A1769 ( 4.6A)
BGC  A1770 ( 3.0A)
 0.95A 3a27A-2cn3A:
undetectable		 3a27A-2cn3A:
15.58
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.
2e3x COAGULATION FACTOR
X-ACTIVATING ENZYME
HEAVY CHAIN

(Daboia
siamensis) 		PF00200
(Disintegrin)
PF01421
(Reprolysin)
PF08516
(ADAM_CR) 		3 MET A 396
GLU A  83
ASN A 354
 None
None
NAG  A 900 ( 3.4A)
 1.10A 3a27A-2e3xA:
undetectable		 3a27A-2e3xA:
18.52
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2e7z ACETYLENE HYDRATASE
AHY

(Pelobacter
acetylenicus) 		PF00384
(Molybdopterin)
PF01568
(Molydop_binding) 		3 MET A 126
GLU A 494
ASN A 114
 None
None
MGD  A 801 (-3.2A)
 0.90A 3a27A-2e7zA:
undetectable		 3a27A-2e7zA:
16.51
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.
2fhe GLUTATHIONE
S-TRANSFERASE

(Fasciola
hepatica) 		PF02798
(GST_N)
PF14497
(GST_C_3) 		3 MET A 179
GLU A 156
ASN A 203
 None
 1.08A 3a27A-2fheA:
undetectable		 3a27A-2fheA:
22.84
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.
2g8g CAPSID

(Adeno-associated
dependoparvovirus
A) 		PF00740
(Parvo_coat) 		3 MET A 362
GLU A 350
ASN A 548
 None
 1.12A 3a27A-2g8gA:
undetectable		 3a27A-2g8gA:
19.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2hro PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Staphylococcus
carnosus) 		PF00391
(PEP-utilizers)
PF02896
(PEP-utilizers_C)
PF05524
(PEP-utilisers_N) 		3 MET A 308
GLU A 311
ASN A 413
 None
 1.06A 3a27A-2hroA:
undetectable		 3a27A-2hroA:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2o2q FORMYLTETRAHYDROFOLA
TE DEHYDROGENASE

(Rattus
norvegicus) 		PF00171
(Aldedh) 		3 MET A 496
GLU A 507
ASN A 574
 None
None
NAP  A 903 (-3.3A)
 1.07A 3a27A-2o2qA:
4.9		 3a27A-2o2qA:
19.38
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.
2p24 H-2 CLASS II
HISTOCOMPATIBILITY
ANTIGEN, A-U ALPHA
CHAIN

(Mus musculus) 		PF00993
(MHC_II_alpha)
PF07654
(C1-set) 		3 MET A  44
GLU A  25
ASN A 140
 None
 0.98A 3a27A-2p24A:
undetectable		 3a27A-2p24A:
21.68
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.
2qps ALPHA-AMYLASE TYPE A
ISOZYME

(Hordeum vulgare) 		PF00128
(Alpha-amylase)
PF07821
(Alpha-amyl_C2) 		3 MET A 298
GLU A 205
ASN A  92
 None
None
CA  A 500 (-2.9A)
 1.06A 3a27A-2qpsA:
undetectable		 3a27A-2qpsA:
22.11
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2r87 PURP PROTEIN PF1517

(Pyrococcus
furiosus) 		PF06849
(DUF1246)
PF06973
(DUF1297) 		3 MET A 197
GLU A 319
ASN A 326
 None
 1.10A 3a27A-2r87A:
3.5		 3a27A-2r87A:
21.19
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.
2w37 ORNITHINE
CARBAMOYLTRANSFERASE
, CATABOLIC

(Lactobacillus
hilgardii) 		PF00185
(OTCace)
PF02729
(OTCace_N) 		3 MET A 330
GLU A  18
ASN A 172
 None
 1.01A 3a27A-2w37A:
4.7		 3a27A-2w37A:
23.76
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.
2wqd PHOSPHOENOLPYRUVATE-
PROTEIN
PHOSPHOTRANSFERASE

(Staphylococcus
aureus) 		PF00391
(PEP-utilizers)
PF02896
(PEP-utilizers_C)
PF05524
(PEP-utilisers_N) 		3 MET A 309
GLU A 312
ASN A 414
 None
 1.01A 3a27A-2wqdA:
undetectable		 3a27A-2wqdA:
17.68
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.
2zbm PROTEIN-TYROSINE-PHO
SPHATASE

(Shewanella sp.) 		PF00149
(Metallophos) 		3 MET A 129
GLU A 151
ASN A 149
 None
None
ZN  A 402 (-2.7A)
 1.04A 3a27A-2zbmA:
undetectable		 3a27A-2zbmA:
20.68
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3a27 UNCHARACTERIZED
PROTEIN MJ1557

(Methanocaldococcus
jannaschii) 		PF02475
(Met_10) 		3 MET A  78
GLU A 127
ASN A 155
 SAM  A 250 (-4.2A)
SAM  A 250 (-3.0A)
SAM  A 250 (-3.6A)
 0.00A 3a27A-3a27A:
40.6		 3a27A-3a27A:
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.
3aib GLUCOSYLTRANSFERASE-
SI

(Streptococcus
mutans) 		PF02324
(Glyco_hydro_70) 		3 MET A 535
GLU A 858
ASN A 862
 None
 1.02A 3a27A-3aibA:
undetectable		 3a27A-3aibA:
16.19
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.
3aib GLUCOSYLTRANSFERASE-
SI

(Streptococcus
mutans) 		PF02324
(Glyco_hydro_70) 		3 MET A 535
GLU A 858
ASN A 914
 None
 0.93A 3a27A-3aibA:
undetectable		 3a27A-3aibA:
16.19
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.
3csq MORPHOGENESIS
PROTEIN 1

(Bacillus virus
phi29) 		no annotation 3 MET A  42
GLU A 100
ASN A 102
 None
 1.12A 3a27A-3csqA:
undetectable		 3a27A-3csqA:
19.24
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.
3csz MORPHOGENESIS
PROTEIN 1

(Bacillus virus
phi29) 		no annotation 3 MET A  42
GLU A 100
ASN A 102
 None
 1.12A 3a27A-3cszA:
undetectable		 3a27A-3cszA:
19.13
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.
3dec BETA-GALACTOSIDASE

(Bacteroides
thetaiotaomicron) 		PF00703
(Glyco_hydro_2)
PF02836
(Glyco_hydro_2_C)
PF02837
(Glyco_hydro_2_N)
PF02929
(Bgal_small_N)
PF16353
(DUF4981) 		3 MET A 500
GLU A 410
ASN A 412
 None
 0.76A 3a27A-3decA:
2.0		 3a27A-3decA:
14.27
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.
3e20 EUKARYOTIC PEPTIDE
CHAIN RELEASE FACTOR
SUBUNIT 1

(Schizosaccharomyces
pombe) 		no annotation 3 MET C  48
GLU C  40
ASN C 118
 None
 1.05A 3a27A-3e20C:
undetectable		 3a27A-3e20C:
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.
3grc SENSOR PROTEIN,
KINASE

(Polaromonas sp.
JS666) 		PF00072
(Response_reg) 		3 MET A 566
GLU A 554
ASN A 600
 None
 0.94A 3a27A-3grcA:
2.7		 3a27A-3grcA:
18.22
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.
3gve YFKN PROTEIN

(Bacillus
subtilis) 		PF00149
(Metallophos) 		3 MET A  93
GLU A 107
ASN A 105
 None
None
MG  A 403 ( 2.6A)
 0.93A 3a27A-3gveA:
undetectable		 3a27A-3gveA:
21.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3hmj FATTY ACID SYNTHASE
SUBUNIT ALPHA

(Saccharomyces
cerevisiae) 		PF00109
(ketoacyl-synt)
PF01648
(ACPS)
PF02801
(Ketoacyl-synt_C) 		3 MET A 529
GLU A 889
ASN A 882
 None
 0.95A 3a27A-3hmjA:
5.6		 3a27A-3hmjA:
9.17
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.
3hvm AGMATINE DEIMINASE

(Helicobacter
pylori) 		PF04371
(PAD_porph) 		3 MET A   4
GLU A   7
ASN A 274
 None
 1.07A 3a27A-3hvmA:
undetectable		 3a27A-3hvmA:
21.69
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.
3ib5 SEX PHEROMONE
PRECURSOR

(Lactobacillus
salivarius) 		PF07537
(CamS) 		3 MET A 156
GLU A 152
ASN A 110
 None
 1.02A 3a27A-3ib5A:
undetectable		 3a27A-3ib5A:
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.
3jyf 2',3'-CYCLIC
NUCLEOTIDE
2'-PHOSPHODIESTERASE
/3'-NUCLEOTIDASE
BIFUNCTIONAL
PERIPLASMIC PROTEIN

(Klebsiella
pneumoniae) 		PF00149
(Metallophos) 		3 MET A  89
GLU A 103
ASN A 101
 None
None
MN  A 342 ( 2.7A)
 1.09A 3a27A-3jyfA:
undetectable		 3a27A-3jyfA:
22.71
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.
3k1u BETA-XYLOSIDASE,
FAMILY 43 GLYCOSYL
HYDROLASE

(Clostridium
acetobutylicum) 		PF04616
(Glyco_hydro_43) 		3 MET A 104
GLU A  75
ASN A 261
 None
MG  A 409 (-3.1A)
None
 1.06A 3a27A-3k1uA:
undetectable		 3a27A-3k1uA:
21.99
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.
3k8p DSL1
PROTEIN TRANSPORT
PROTEIN SEC39

(Kluyveromyces
lactis;
Saccharomyces
cerevisiae) 		PF11989
(Dsl1_C)
PF08314
(Sec39) 		3 MET D 608
GLU C 356
ASN C 477
 None
 0.90A 3a27A-3k8pD:
undetectable		 3a27A-3k8pD:
17.44
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.
3kal HOMOGLUTATHIONE
SYNTHETASE

(Glycine max) 		PF03199
(GSH_synthase)
PF03917
(GSH_synth_ATP) 		3 MET A 473
GLU A 169
ASN A 396
 None
MG  A 502 (-1.9A)
ADP  A 500 ( 4.8A)
 0.93A 3a27A-3kalA:
undetectable		 3a27A-3kalA:
20.44
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.
3kh5 PROTEIN MJ1225

(Methanocaldococcus
jannaschii) 		PF00571
(CBS) 		3 MET A 249
GLU A 133
ASN A 114
 None
ADP  A 284 ( 4.6A)
ADP  A 284 ( 4.9A)
 1.12A 3a27A-3kh5A:
undetectable		 3a27A-3kh5A:
23.64
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.
3l0o TRANSCRIPTION
TERMINATION FACTOR
RHO

(Thermotoga
maritima) 		PF00006
(ATP-synt_ab)
PF07497
(Rho_RNA_bind)
PF07498
(Rho_N) 		3 MET A 120
GLU A  23
ASN A  17
 None
 1.11A 3a27A-3l0oA:
undetectable		 3a27A-3l0oA:
22.15
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.
3la4 UREASE

(Canavalia
ensiformis) 		PF00449
(Urease_alpha)
PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF01979
(Amidohydro_1) 		3 MET A 637
GLU A 493
ASN A 524
 PO4  A 843 ( 4.1A)
PO4  A 844 (-3.8A)
None
 0.89A 3a27A-3la4A:
undetectable		 3a27A-3la4A:
16.39
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.
3ngf AP ENDONUCLEASE,
FAMILY 2

(Brucella
abortus) 		PF01261
(AP_endonuc_2) 		3 MET A 105
GLU A 239
ASN A 241
 None
MN  A 262 (-2.7A)
None
 1.09A 3a27A-3ngfA:
undetectable		 3a27A-3ngfA:
23.23
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.
3nwg MICROCOMPARTMENTS
PROTEIN

(Desulfitobacterium
hafniense) 		PF00936
(BMC) 		3 MET A 162
GLU A   8
ASN A  10
 None
 1.10A 3a27A-3nwgA:
undetectable		 3a27A-3nwgA:
21.22
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.
3odg XANTHOSINE
PHOSPHORYLASE

(Yersinia
pseudotuberculosis) 		PF01048
(PNP_UDP_1) 		3 MET A 148
GLU A 205
ASN A 247
 None
XAN  A 288 (-2.8A)
XAN  A 288 (-3.0A)
 1.06A 3a27A-3odgA:
undetectable		 3a27A-3odgA:
21.50
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.
3p5p TAXADIENE SYNTHASE

(Taxus
brevifolia) 		PF01397
(Terpene_synth)
PF03936
(Terpene_synth_C) 		3 MET A 571
GLU A 660
ASN A 662
 None
 1.11A 3a27A-3p5pA:
undetectable		 3a27A-3p5pA:
16.84
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.
3qgk UREASE SUBUNIT BETA
2

(Helicobacter
mustelae) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		3 MET C 365
GLU C 221
ASN C 252
 None
 1.02A 3a27A-3qgkC:
undetectable		 3a27A-3qgkC:
19.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4amc GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		3 MET A1081
GLU A1412
ASN A1416
 None
 1.03A 3a27A-4amcA:
undetectable		 3a27A-4amcA:
13.42
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.
4amc GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		3 MET A1081
GLU A1412
ASN A1468
 None
 1.11A 3a27A-4amcA:
undetectable		 3a27A-4amcA:
13.42
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.
4ayg GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		3 MET A1083
GLU A1407
ASN A1411
 None
 0.97A 3a27A-4aygA:
undetectable		 3a27A-4aygA:
14.01
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.
4ayg GLUCANSUCRASE

(Lactobacillus
reuteri) 		PF01473
(CW_binding_1)
PF02324
(Glyco_hydro_70) 		3 MET A1083
GLU A1407
ASN A1463
 None
 1.00A 3a27A-4aygA:
undetectable		 3a27A-4aygA:
14.01
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.
4cr4 26S PROTEASE
REGULATORY SUBUNIT 8
HOMOLOG
26S PROTEASE
REGULATORY SUBUNIT
6B HOMOLOG

(Saccharomyces
cerevisiae;
Saccharomyces
cerevisiae) 		PF00004
(AAA)
PF00004
(AAA) 		3 MET K 316
GLU J 395
ASN J 393
 None
 1.10A 3a27A-4cr4K:
undetectable		 3a27A-4cr4K:
21.91
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.
4du5 PFKB

(Polaromonas sp.
JS666) 		PF00294
(PfkB) 		3 MET A 140
GLU A  61
ASN A  63
 None
 1.01A 3a27A-4du5A:
3.6		 3a27A-4du5A:
21.87
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.
4e3w ACID PHOSPHATASE

(Francisella
tularensis) 		PF00328
(His_Phos_2) 		3 MET A  13
GLU A  48
ASN A  46
 None
 1.07A 3a27A-4e3wA:
undetectable		 3a27A-4e3wA:
20.28
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.
4fnm E3 ALPHA-ESTERASE-7
CARBOXYLESTERASE

(Lucilia cuprina) 		PF00135
(COesterase) 		3 MET A 227
GLU A 316
ASN A 181
 None
 1.00A 3a27A-4fnmA:
undetectable		 3a27A-4fnmA:
18.77
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.
4frt PROBABLE PORIN

(Pseudomonas
aeruginosa) 		PF03573
(OprD) 		3 MET A 272
GLU A 344
ASN A 378
 None
 1.08A 3a27A-4frtA:
undetectable		 3a27A-4frtA:
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.
4g7e UREASE

(Cajanus cajan) 		PF00449
(Urease_alpha)
PF00547
(Urease_gamma)
PF00699
(Urease_beta)
PF01979
(Amidohydro_1) 		3 MET B 637
GLU B 493
ASN B 524
 CME  B 592 ( 4.9A)
None
None
 0.94A 3a27A-4g7eB:
undetectable		 3a27A-4g7eB:
15.81
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.
4kqb PROTEIN H03A11.1

(Caenorhabditis
elegans) 		PF06702
(Fam20C) 		3 MET A 171
GLU A 213
ASN A 364
 None
MN  A 606 ( 3.0A)
None
 1.08A 3a27A-4kqbA:
undetectable		 3a27A-4kqbA:
20.43
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.
4lih GAMMA-GLUTAMYL-GAMMA
-AMINOBUTYRALDEHYDE
DEHYDROGENASE

(Burkholderia
cenocepacia) 		PF00171
(Aldedh) 		3 MET A  94
GLU A 105
ASN A 168
 None
None
MES  A 501 (-3.6A)
 0.89A 3a27A-4lihA:
undetectable		 3a27A-4lihA:
19.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4nko ENGINEERED SCFV
LIGHT CHAIN

(Mus musculus) 		PF07686
(V-set) 		3 MET A   4
GLU A  39
ASN A  58
 None
 1.01A 3a27A-4nkoA:
undetectable		 3a27A-4nkoA:
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.
4nql AMSH-LIKE PROTEASE
SST2

(Schizosaccharomyces
pombe) 		PF01398
(JAB) 		3 MET A 373
GLU A 422
ASN A 424
 None
 1.00A 3a27A-4nqlA:
undetectable		 3a27A-4nqlA:
21.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4rf3 NADPH DEPENDENT
R-SPECIFIC ALCOHOL
DEHYDROGENASE

(Lactobacillus
kefiri) 		PF13561
(adh_short_C2) 		3 MET A 206
GLU A 145
ASN A 114
 None
 0.89A 3a27A-4rf3A:
6.4		 3a27A-4rf3A:
25.48
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.
4rl6 SACCHAROPINE
DEHYDROGENASE

(Streptococcus
pneumoniae) 		PF03435
(Sacchrp_dh_NADP)
PF16653
(Sacchrp_dh_C) 		3 MET A 229
GLU A 210
ASN A 201
 None
 1.13A 3a27A-4rl6A:
5.3		 3a27A-4rl6A:
22.15
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.
4w8o LUCIFERASE-LIKE
ENZYMEAMP-COA-LIGASE

(Zophobas
atratus) 		PF00501
(AMP-binding) 		3 MET A 250
GLU A 253
ASN A 282
 None
 1.10A 3a27A-4w8oA:
undetectable		 3a27A-4w8oA:
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.
4wai COMF OPERON PROTEIN
2

(Bacillus
subtilis) 		PF10719
(ComFB) 		3 MET A   1
GLU A   7
ASN A  32
 None
 0.89A 3a27A-4waiA:
undetectable		 3a27A-4waiA:
25.73
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.
4ye5 PEPTIDOGLYCAN
SYNTHETASE
PENICILLIN-BINDING
PROTEIN 3

(Bifidobacterium
adolescentis) 		PF00905
(Transpeptidase)
PF03717
(PBP_dimer) 		3 MET A 210
GLU A 413
ASN A 447
 None
 1.10A 3a27A-4ye5A:
undetectable		 3a27A-4ye5A:
16.73
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.
4z42 UREASE SUBUNIT ALPHA

(Yersinia
enterocolitica) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		3 MET C 369
GLU C 225
ASN C 256
 None
 0.93A 3a27A-4z42C:
undetectable		 3a27A-4z42C:
18.71
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.
4zd5 AMSH-LIKE PROTEASE
SST2

(Schizosaccharomyces
pombe) 		PF01398
(JAB) 		3 MET A 373
GLU A 422
ASN A 424
 None
 1.11A 3a27A-4zd5A:
undetectable		 3a27A-4zd5A:
21.15
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.
5aee ALPHA-GLUCOSIDASE
YIHQ

(Escherichia
coli) 		PF01055
(Glyco_hydro_31) 		3 MET A 403
GLU A 408
ASN A  54
 NSQ  A1681 (-3.6A)
None
None
 0.81A 3a27A-5aeeA:
undetectable		 3a27A-5aeeA:
18.04
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.
5eqv BIFUNCTIONAL
2',3'-CYCLIC
NUCLEOTIDE
2'-PHOSPHODIESTERASE
/3'-NUCLEOTIDASE
PERIPLASMIC
PRECURSOR PROTEIN

(Yersinia pestis) 		PF00149
(Metallophos) 		3 MET A 112
GLU A 126
ASN A 124
 None
None
PO4  A 405 (-2.6A)
 1.10A 3a27A-5eqvA:
undetectable		 3a27A-5eqvA:
21.53
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.
5fse UREASE SUBUNIT ALPHA

(Sporosarcina
pasteurii) 		PF00449
(Urease_alpha)
PF01979
(Amidohydro_1) 		3 MET C 367
GLU C 223
ASN C 254
 SO4  C1579 ( 4.3A)
SO4  C1579 ( 4.5A)
None
 0.82A 3a27A-5fseC:
undetectable		 3a27A-5fseC:
21.39
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gw5 T-COMPLEX PROTEIN 1
SUBUNIT ZETA

(Saccharomyces
cerevisiae) 		PF00118
(Cpn60_TCP1) 		3 MET z 130
GLU z 123
ASN z 526
 None
 1.08A 3a27A-5gw5z:
undetectable		 3a27A-5gw5z:
19.64
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.
5hn4 HOMOISOCITRATE
DEHYDROGENASE

(Thermococcus
kodakarensis) 		PF00180
(Iso_dh) 		3 MET A 325
GLU A 318
ASN A 295
 None
 0.96A 3a27A-5hn4A:
undetectable		 3a27A-5hn4A:
23.39
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.
5ijl DNA POLYMERASE II
LARGE SUBUNIT

(Pyrococcus
abyssi) 		PF03833
(PolC_DP2) 		3 MET A 211
GLU A 187
ASN A 239
 None
 1.09A 3a27A-5ijlA:
undetectable		 3a27A-5ijlA:
13.77
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.
5jif HEMAGGLUTININ-ESTERA
SE

(Murine
coronavirus) 		PF02710
(Hema_HEFG)
PF03996
(Hema_esterase) 		3 MET A 141
GLU A 105
ASN A  80
 None
 0.85A 3a27A-5jifA:
undetectable		 3a27A-5jifA:
18.04
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.
5jwz CELLULOSE-BINDING
FAMILY II

(Streptomyces
sp. SirexAA-E) 		PF02012
(BNR) 		3 MET A 382
GLU A 430
ASN A 722
 None
 1.10A 3a27A-5jwzA:
undetectable		 3a27A-5jwzA:
14.43
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.
5k6o B-GLUCOSIDASE

(metagenome) 		PF00933
(Glyco_hydro_3)
PF01915
(Glyco_hydro_3_C)
PF14310
(Fn3-like) 		3 MET A  62
GLU A 600
ASN A 635
 None
 0.94A 3a27A-5k6oA:
undetectable		 3a27A-5k6oA:
15.74
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5m8b ALPHA-L-ARABINOFURAN
OSIDASE II

(Lactobacillus
brevis) 		PF04616
(Glyco_hydro_43) 		3 MET A 108
GLU A  78
ASN A 267
 None
MG  A 401 (-3.1A)
None
 1.10A 3a27A-5m8bA:
undetectable		 3a27A-5m8bA:
23.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n11 HEMAGGLUTININ-ESTERA
SE

(Betacoronavirus
1) 		PF02710
(Hema_HEFG)
PF03996
(Hema_esterase) 		3 MET A 137
GLU A 101
ASN A  76
 None
 0.81A 3a27A-5n11A:
undetectable		 3a27A-5n11A:
22.22
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n1q METHYL-COENZYME M
REDUCTASE III FROM
METHANOTHERMOCOCCUS
THERMOLITHOTROPHICUS
SUBUNIT BETA
METHYL-COENZYME M
REDUCTASE III FROM
METHANOTHERMOCOCCUS
THERMOLITHOTROPHICUS
SUBUNIT GAMMA

(Methanothermococcus
thermolithotrophicus;
Methanothermococcus
thermolithotrophicus) 		PF02241
(MCR_beta)
PF02783
(MCR_beta_N)
PF02240
(MCR_gamma) 		3 MET C  62
GLU B 409
ASN B 198
 None
 1.08A 3a27A-5n1qC:
undetectable		 3a27A-5n1qC:
21.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5n6u BETA-MANNOSIDASE

(Dictyoglomus
thermophilum) 		PF00703
(Glyco_hydro_2)
PF02837
(Glyco_hydro_2_N) 		3 MET A 103
GLU A 364
ASN A 602
 None
 1.08A 3a27A-5n6uA:
undetectable		 3a27A-5n6uA:
16.87
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.
5ngy DSR-M GLUCANSUCRASE
INACTIVE MUTANT
E715Q

(Leuconostoc
citreum) 		no annotation 3 MET A 736
GLU A1064
ASN A1068
 None
 0.95A 3a27A-5ngyA:
undetectable		 3a27A-5ngyA:
11.33
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.
5njf METALLOPROTEASE TLDD
METALLOPROTEASE PMBA

(Escherichia
coli;
Escherichia
coli) 		PF01523
(PmbA_TldD)
PF01523
(PmbA_TldD) 		3 MET A 360
GLU B  59
ASN B 164
 None
 1.07A 3a27A-5njfA:
undetectable		 3a27A-5njfA:
21.17
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.
5ohs -

(-) 		no annotation 3 MET A 386
GLU A 391
ASN A  44
 NSQ  A 709 (-3.5A)
None
EDO  A 708 ( 4.7A)
 0.83A 3a27A-5ohsA:
undetectable		 3a27A-5ohsA:
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.
5oqr CONDENSIN COMPLEX
SUBUNIT 3
CONDENSIN COMPLEX
SUBUNIT 2

(Schizosaccharomyces
pombe;
Schizosaccharomyces
pombe) 		no annotation
no annotation 		3 MET C 537
GLU A 416
ASN A 513
 None
 1.00A 3a27A-5oqrC:
undetectable		 3a27A-5oqrC:
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.
5u6u CYTOCHROME P450

(Rhodopseudomonas
palustris) 		no annotation 3 MET A 121
GLU A 369
ASN A 283
 None
 1.12A 3a27A-5u6uA:
undetectable		 3a27A-5u6uA:
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.
5wtk CRISPR-ASSOCIATED
ENDORIBONUCLEASE
C2C2

(Leptotrichia
shahii) 		no annotation 3 MET A 277
GLU A 301
ASN A 306
 None
 1.00A 3a27A-5wtkA:
undetectable		 3a27A-5wtkA:
11.67
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xzd ENOYL-COA HYDRATASE

(Roseovarius
nubinhibens) 		no annotation 3 MET A 115
GLU A 132
ASN A 134
 None
ACY  A 301 (-3.5A)
None
 1.04A 3a27A-5xzdA:
undetectable		 3a27A-5xzdA:
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.
6b3y DENN
DOMAIN-CONTAINING
PROTEIN 3

(Mus musculus) 		no annotation 3 MET A 730
GLU A 741
ASN A 722
 None
 1.13A 3a27A-6b3yA:
undetectable		 3a27A-6b3yA:
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.
6fdg 4-HYDROXYBENZOYL-COA
THIOESTERASE

(Staphylococcus
aureus) 		no annotation 3 MET A   1
GLU A  93
ASN A  63
 None
 1.03A 3a27A-6fdgA:
undetectable		 3a27A-6fdgA:
undetectable