SIMILAR PATTERNS OF AMINO ACIDS FOR 4PQA_A_X8ZA401_1

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.
1cg2 CARBOXYPEPTIDASE G2

(Pseudomonas sp.
RS-16) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		8 HIS A 112
ASP A 141
GLU A 175
GLU A 176
GLU A 200
GLY A 358
GLY A 359
HIS A 385
 ZN  A 501 ( 3.3A)
ZN  A 500 (-2.4A)
ZN  A 501 (-3.9A)
ZN  A 500 ( 2.0A)
ZN  A 501 ( 1.9A)
None
None
ZN  A 500 ( 3.2A)
 0.55A 4pqaA-1cg2A:
35.0		 4pqaA-1cg2A:
26.29
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.
1cg2 CARBOXYPEPTIDASE G2

(Pseudomonas sp.
RS-16) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		6 HIS A 112
ASP A 141
GLU A 176
GLU A 200
GLY A 360
HIS A 385
 ZN  A 501 ( 3.3A)
ZN  A 500 (-2.4A)
ZN  A 500 ( 2.0A)
ZN  A 501 ( 1.9A)
None
ZN  A 500 ( 3.2A)
 0.87A 4pqaA-1cg2A:
35.0		 4pqaA-1cg2A:
26.29
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.
1f2p AMINOPEPTIDASE

(Streptomyces
griseus) 		PF04389
(Peptidase_M28) 		5 HIS A  85
ASP A  97
GLU A 131
GLU A 132
HIS A 247
 ZN  A 901 ( 3.3A)
ZN  A 902 (-2.5A)
PHE  A 903 (-2.8A)
ZN  A 902 ( 2.2A)
ZN  A 902 ( 3.3A)
 0.38A 4pqaA-1f2pA:
22.8		 4pqaA-1f2pA:
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.
1fno PEPTIDASE T

(Salmonella
enterica) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A  78
ASP A 140
GLU A 173
GLU A 174
HIS A 379
 ZN  A 501 (-3.4A)
ZN  A 501 ( 2.5A)
ZN  A 501 ( 4.4A)
ZN  A 502 (-2.6A)
ZN  A 502 (-3.8A)
 0.39A 4pqaA-1fnoA:
31.9		 4pqaA-1fnoA:
24.50
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.
1fno PEPTIDASE T

(Salmonella
enterica) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A  78
ASP A 140
GLU A 174
GLY A 354
HIS A 379
 ZN  A 501 (-3.4A)
ZN  A 501 ( 2.5A)
ZN  A 502 (-2.6A)
SO4  A 600 (-3.5A)
ZN  A 502 (-3.8A)
 0.90A 4pqaA-1fnoA:
31.9		 4pqaA-1fnoA:
24.50
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.
1fno PEPTIDASE T

(Salmonella
enterica) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A  78
GLU A 173
GLU A 174
GLY A 354
HIS A 379
 ZN  A 501 (-3.4A)
ZN  A 501 ( 4.4A)
ZN  A 502 (-2.6A)
SO4  A 600 (-3.5A)
ZN  A 502 (-3.8A)
 0.73A 4pqaA-1fnoA:
31.9		 4pqaA-1fnoA:
24.50
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.
1lfw PEPV

(Lactobacillus
delbrueckii) 		PF01546
(Peptidase_M20) 		6 HIS A  87
ASP A 119
GLU A 153
GLU A 154
GLY A 413
HIS A 439
 ZN  A1002 ( 3.2A)
ZN  A1001 (-2.4A)
AEP  A 683 (-2.7A)
ZN  A1001 ( 1.9A)
None
ZN  A1001 ( 3.1A)
 0.58A 4pqaA-1lfwA:
29.9		 4pqaA-1lfwA:
25.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1lfw PEPV

(Lactobacillus
delbrueckii) 		PF01546
(Peptidase_M20) 		6 HIS A  87
GLU A 153
GLU A 154
GLY A 413
GLY A 414
HIS A 439
 ZN  A1002 ( 3.2A)
AEP  A 683 (-2.7A)
ZN  A1001 ( 1.9A)
None
AEP  A 683 (-3.6A)
ZN  A1001 ( 3.1A)
 1.03A 4pqaA-1lfwA:
29.9		 4pqaA-1lfwA:
25.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1q7l AMINOACYLASE-1

(Homo sapiens) 		PF01546
(Peptidase_M20) 		6 HIS A  80
ASP A 113
GLU A 147
GLU A 148
GLU A 175
HIS B 373
 ZN  A1002 ( 3.2A)
ZN  A1002 (-2.5A)
ZN  A1002 ( 3.8A)
ZN  A1001 (-1.9A)
ZN  A1002 ( 1.9A)
ZN  A1001 ( 3.2A)
 0.22A 4pqaA-1q7lA:
17.1		 4pqaA-1q7lA:
20.65
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.
1r3n BETA-ALANINE
SYNTHASE

(Lachancea
kluyveri) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		6 HIS A 114
ASP A 125
GLU A 159
GLU A 160
GLY A 394
HIS A 421
 ZN  A 500 (-3.2A)
ZN  A 501 ( 2.3A)
ZN  A 500 ( 3.9A)
ZN  A 501 (-2.0A)
None
ZN  A 501 (-3.2A)
 0.44A 4pqaA-1r3nA:
28.7		 4pqaA-1r3nA:
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.
1vhe AMINOPEPTIDASE/GLUCA
NASE HOMOLOG

(Bacillus
subtilis) 		PF05343
(Peptidase_M42) 		8 HIS A  68
ASP A 182
GLU A 214
GLU A 215
GLY A 297
GLY A 298
ILE A 324
HIS A 325
 ZN  A 372 (-3.5A)
ZN  A 372 (-2.5A)
ZN  A 372 ( 3.9A)
ZN  A 372 ( 4.5A)
None
None
None
None
 0.92A 4pqaA-1vheA:
22.8		 4pqaA-1vheA:
24.10
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.
1xmb IAA-AMINO ACID
HYDROLASE HOMOLOG 2

(Arabidopsis
thaliana) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A 139
GLU A 172
GLU A 173
GLY A 366
HIS A 397
 None
 0.86A 4pqaA-1xmbA:
28.3		 4pqaA-1xmbA:
26.59
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.
1y0y FRV OPERON PROTEIN
FRVX

(Pyrococcus
horikoshii) 		PF05343
(Peptidase_M42) 		8 HIS A  68
ASP A 182
GLU A 212
GLU A 213
GLY A 295
GLY A 296
ILE A 322
HIS A 323
 ZN  A1001 ( 3.4A)
ZN  A1002 (-2.4A)
ZN  A1001 (-3.8A)
ZN  A1002 ( 2.0A)
None
None
None
ZN  A1002 ( 3.3A)
 0.85A 4pqaA-1y0yA:
23.4		 4pqaA-1y0yA:
24.02
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1ylo HYPOTHETICAL PROTEIN
SF2450

(Shigella
flexneri) 		PF05343
(Peptidase_M42) 		6 HIS A  62
ASP A 166
GLU A 198
GLU A 199
GLY A 281
HIS A 308
 ZN  A1446 (-3.3A)
ZN  A1446 ( 2.3A)
ZN  A1446 ( 4.6A)
ZN  A1447 (-2.0A)
None
ZN  A1447 (-3.2A)
 0.75A 4pqaA-1yloA:
23.5		 4pqaA-1yloA:
25.62
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.
1ysj PROTEIN YXEP

(Bacillus
subtilis) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A 100
GLU A 133
GLU A 134
GLY A 323
HIS A 350
 NI  A 381 (-3.2A)
NI  A 381 (-4.0A)
NI  A 382 ( 2.1A)
None
NI  A 382 (-3.4A)
 0.78A 4pqaA-1ysjA:
28.1		 4pqaA-1ysjA:
24.83
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.
1z8l GLUTAMATE
CARBOXYPEPTIDASE II

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		5 HIS A 377
ASP A 387
GLU A 424
GLU A 425
HIS A 553
 ZN  A1751 (-3.3A)
ZN  A1751 ( 2.6A)
ZN  A1751 (-3.6A)
ZN  A1752 (-2.5A)
ZN  A1752 (-3.3A)
 0.35A 4pqaA-1z8lA:
19.1		 4pqaA-1z8lA:
20.71
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.
1zb7 NEUROTOXIN

(Clostridium
botulinum) 		PF01742
(Peptidase_M27) 		6 GLU A 268
GLU A 267
GLY A 274
GLY A 273
ILE A 233
HIS A 230
 FLC  A 501 ( 3.0A)
None
None
None
None
ZN  A 500 ( 3.3A)
 1.38A 4pqaA-1zb7A:
undetectable		 4pqaA-1zb7A:
21.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2anp LEUCYL
AMINOPEPTIDASE

(Vibrio
proteolyticus) 		PF04389
(Peptidase_M28) 		6 HIS A  97
ASP A 117
GLU A 152
ASN A 252
ILE A 255
HIS A 256
 ZN  A 502 (-3.3A)
ZN  A 501 ( 2.4A)
ZN  A 501 (-2.0A)
None
None
ZN  A 501 (-3.3A)
 1.43A 4pqaA-2anpA:
22.3		 4pqaA-2anpA:
21.81
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.
2ek8 AMINOPEPTIDASE

(Aneurinibacillus
sp. AM-1) 		PF02225
(PA)
PF04389
(Peptidase_M28) 		5 HIS A 228
ASP A 240
GLU A 272
GLU A 273
HIS A 371
 ZN  A1002 (-3.3A)
ZN  A1001 ( 2.4A)
ZN  A1002 ( 3.9A)
ZN  A1001 (-2.0A)
ZN  A1001 (-3.3A)
 0.31A 4pqaA-2ek8A:
23.4		 4pqaA-2ek8A:
22.85
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.
2f7v AECTYLCITRULLINE
DEACETYLASE

(Xanthomonas
campestris) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		6 HIS A  72
ASP A 103
GLU A 130
GLU A 131
GLU A 155
HIS A 340
 CO  A5367 (-3.4A)
CO  A5367 (-2.2A)
CO  A5367 (-3.8A)
CO  A5367 ( 4.0A)
CO  A5367 (-2.1A)
None
 0.33A 4pqaA-2f7vA:
32.6		 4pqaA-2f7vA:
27.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2glf PROBABLE M18-FAMILY
AMINOPEPTIDASE 1

(Thermotoga
maritima) 		PF02127
(Peptidase_M18) 		7 HIS A  94
ASP A 251
GLU A 280
GLU A 281
GLY A 401
GLY A 402
HIS A 427
 MN  A5001 (-3.6A)
MN  A5002 ( 2.7A)
MN  A5001 (-4.4A)
MN  A5002 (-2.1A)
None
None
MN  A5002 (-3.6A)
 1.22A 4pqaA-2glfA:
20.8		 4pqaA-2glfA:
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.
2glj PROBABLE M18-FAMILY
AMINOPEPTIDASE 1

(Clostridium
acetobutylicum) 		PF02127
(Peptidase_M18) 		6 HIS A 105
ASP A 265
GLU A 295
GLU A 296
GLY A 416
HIS A 441
 MN  A6002 (-3.4A)
MN  A6002 ( 2.9A)
MN  A6002 (-3.1A)
MN  A6001 ( 2.2A)
None
MN  A6001 (-4.1A)
 0.78A 4pqaA-2gljA:
19.7		 4pqaA-2gljA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2glj PROBABLE M18-FAMILY
AMINOPEPTIDASE 1

(Clostridium
acetobutylicum) 		PF02127
(Peptidase_M18) 		6 HIS A 105
ASP A 265
GLU A 295
GLY A 415
GLY A 416
HIS A 441
 MN  A6002 (-3.4A)
MN  A6002 ( 2.9A)
MN  A6002 (-3.1A)
None
None
MN  A6001 (-4.1A)
 1.22A 4pqaA-2gljA:
19.7		 4pqaA-2gljA:
21.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pok PEPTIDASE,
M20/M25/M40 FAMILY

(Streptococcus
pneumoniae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		7 HIS A  90
ASP A 123
GLU A 157
GLU A 158
GLU A 184
GLY A 403
HIS A 431
 MN  A 460 (-3.7A)
MN  A 460 (-2.6A)
MN  A 460 ( 3.8A)
MN  A 460 ( 4.9A)
MN  A 460 (-2.3A)
None
None
 0.80A 4pqaA-2pokA:
33.7		 4pqaA-2pokA:
23.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2pok PEPTIDASE,
M20/M25/M40 FAMILY

(Streptococcus
pneumoniae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		7 HIS A  90
ASP A 123
GLU A 157
GLU A 158
GLU A 184
GLY A 403
HIS A 431
 MN  A 460 (-3.7A)
MN  A 460 (-2.6A)
MN  A 460 ( 3.8A)
MN  A 460 ( 4.9A)
MN  A 460 (-2.3A)
None
None
 0.81A 4pqaA-2pokA:
33.7		 4pqaA-2pokA:
23.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qyv XAA-HIS DIPEPTIDASE

(Histophilus
somni) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A  76
ASP A 115
GLU A 145
GLU A 146
GLY A 216
 ZN  A 501 (-3.4A)
ZN  A 501 ( 2.6A)
ZN  A 501 ( 4.2A)
ZN  A 502 (-2.3A)
None
 0.79A 4pqaA-2qyvA:
26.5		 4pqaA-2qyvA:
24.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2qyv XAA-HIS DIPEPTIDASE

(Histophilus
somni) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A  76
ASP A 115
GLU A 145
GLU A 146
HIS A 458
 ZN  A 501 (-3.4A)
ZN  A 501 ( 2.6A)
ZN  A 501 ( 4.2A)
ZN  A 502 (-2.3A)
ZN  A 502 ( 3.5A)
 0.32A 4pqaA-2qyvA:
26.5		 4pqaA-2qyvA:
24.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2rb7 PEPTIDASE,
M20/M25/M40 FAMILY

(Desulfovibrio
alaskensis) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		6 HIS A  72
ASP A  99
GLU A 138
GLU A 139
GLY A 306
HIS A 332
 None
 0.34A 4pqaA-2rb7A:
34.2		 4pqaA-2rb7A:
28.50
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.
2wyr COBALT-ACTIVATED
PEPTIDASE TET1

(Pyrococcus
horikoshii) 		PF05343
(Peptidase_M42) 		6 HIS A  61
ASP A 172
GLU A 204
GLU A 205
GLY A 282
HIS A 306
 CO  A1333 (-3.4A)
CO  A1333 ( 2.4A)
CO  A1333 ( 3.7A)
CO  A1332 (-2.1A)
None
CO  A1332 (-3.5A)
 0.65A 4pqaA-2wyrA:
24.5		 4pqaA-2wyrA:
25.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wyr COBALT-ACTIVATED
PEPTIDASE TET1

(Pyrococcus
horikoshii) 		PF05343
(Peptidase_M42) 		6 HIS A  61
ASP A 172
GLU A 204
GLY A 281
GLY A 282
HIS A 306
 CO  A1333 (-3.4A)
CO  A1333 ( 2.4A)
CO  A1333 ( 3.7A)
None
None
CO  A1332 (-3.5A)
 0.78A 4pqaA-2wyrA:
24.5		 4pqaA-2wyrA:
25.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wyr COBALT-ACTIVATED
PEPTIDASE TET1

(Pyrococcus
horikoshii) 		PF05343
(Peptidase_M42) 		5 HIS A  61
ASP A 172
GLU A 205
GLY A 281
HIS A 306
 CO  A1333 (-3.4A)
CO  A1333 ( 2.4A)
CO  A1332 (-2.1A)
None
CO  A1332 (-3.5A)
 0.54A 4pqaA-2wyrA:
24.5		 4pqaA-2wyrA:
25.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wyr COBALT-ACTIVATED
PEPTIDASE TET1

(Pyrococcus
horikoshii) 		PF05343
(Peptidase_M42) 		6 HIS A  61
GLU A 204
ARG A 248
GLY A 281
GLY A 282
HIS A 306
 CO  A1333 (-3.4A)
CO  A1333 ( 3.7A)
None
None
None
CO  A1332 (-3.5A)
 1.06A 4pqaA-2wyrA:
24.5		 4pqaA-2wyrA:
25.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wyr COBALT-ACTIVATED
PEPTIDASE TET1

(Pyrococcus
horikoshii) 		PF05343
(Peptidase_M42) 		6 HIS A  61
GLU A 204
GLU A 205
ARG A 248
GLY A 282
HIS A 306
 CO  A1333 (-3.4A)
CO  A1333 ( 3.7A)
CO  A1332 (-2.1A)
None
None
CO  A1332 (-3.5A)
 1.00A 4pqaA-2wyrA:
24.5		 4pqaA-2wyrA:
25.93
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3bzj UV ENDONUCLEASE

(Thermus
thermophilus) 		PF03851
(UvdE) 		5 HIS A 231
GLU A 175
GLU A 269
GLY A 242
HIS A 143
 None
None
MN  A 281 ( 4.9A)
None
None
 0.91A 4pqaA-3bzjA:
undetectable		 4pqaA-3bzjA:
20.56
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.
3cpx AMINOPEPTIDASE, M42
FAMILY

(Cytophaga
hutchinsonii) 		PF05343
(Peptidase_M42) 		6 HIS A  65
ASP A 146
GLU A 172
GLU A 173
GLY A 250
HIS A 277
 FE  A 400 (-3.2A)
FE  A 400 ( 2.4A)
FE  A 400 (-3.7A)
FE  A 401 ( 2.0A)
EDO  A 404 (-4.1A)
FE  A 401 (-3.4A)
 0.42A 4pqaA-3cpxA:
22.3		 4pqaA-3cpxA:
25.49
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.
3ct9 ACETYLORNITHINE
DEACETYLASE

(Bacteroides
thetaiotaomicron) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		6 HIS A  73
ASP A 104
GLU A 136
GLU A 137
GLU A 161
HIS A 328
 None
 0.39A 4pqaA-3ct9A:
33.2		 4pqaA-3ct9A:
27.75
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.
3ct9 ACETYLORNITHINE
DEACETYLASE

(Bacteroides
thetaiotaomicron) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		6 HIS A  73
GLU A 136
GLU A 137
GLU A 161
ASN A 103
HIS A 328
 None
 1.33A 4pqaA-3ct9A:
33.2		 4pqaA-3ct9A:
27.75
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.
3dlj BETA-ALA-HIS
DIPEPTIDASE

(Homo sapiens) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A 106
ASP A 139
GLU A 173
GLU A 174
HIS A 452
 ZN  A2002 (-3.2A)
ZN  A2001 ( 2.4A)
UNX  A2004 ( 3.2A)
ZN  A2001 (-2.1A)
ZN  A2001 (-3.2A)
 0.28A 4pqaA-3dljA:
32.5		 4pqaA-3dljA:
27.13
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.
3fed GLUTAMATE
CARBOXYPEPTIDASE III

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		5 HIS A 367
ASP A 377
GLU A 414
GLU A 415
HIS A 543
 ZN  A1752 ( 3.3A)
ZN  A1751 (-2.5A)
BIX  A   1 ( 2.7A)
ZN  A1751 ( 1.9A)
ZN  A1751 ( 3.2A)
 0.44A 4pqaA-3fedA:
19.5		 4pqaA-3fedA:
21.30
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3g77 CYTOSINE DEAMINASE

(Escherichia
coli) 		PF07969
(Amidohydro_3) 		5 HIS A 246
ASP A 313
GLU A 217
GLY A  84
HIS A  63
 FE  A 502 ( 4.8A)
FE  A 502 (-3.2A)
None
None
FE  A 502 (-3.1A)
 0.91A 4pqaA-3g77A:
undetectable		 4pqaA-3g77A:
22.53
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.
3gb0 PEPTIDASE T

(Bacillus cereus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A  77
ASP A 107
GLU A 140
GLU A 141
GLY A 320
 None
None
None
None
GOL  A 373 ( 3.7A)
 0.66A 4pqaA-3gb0A:
35.0		 4pqaA-3gb0A:
25.12
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.
3gb0 PEPTIDASE T

(Bacillus cereus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		6 HIS A  77
ASP A 107
GLU A 140
GLU A 141
ILE A 344
HIS A 345
 None
 0.25A 4pqaA-3gb0A:
35.0		 4pqaA-3gb0A:
25.12
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.
3gb0 PEPTIDASE T

(Bacillus cereus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		6 HIS A  77
ASP A 107
GLU A 141
GLY A 320
ILE A 344
HIS A 345
 None
None
None
GOL  A 373 ( 3.7A)
None
None
 1.12A 4pqaA-3gb0A:
35.0		 4pqaA-3gb0A:
25.12
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.
3gb0 PEPTIDASE T

(Bacillus cereus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A  77
GLU A 140
GLU A 141
GLY A 319
GLY A 320
 None
None
None
PEG  A 377 ( 4.1A)
GOL  A 373 ( 3.7A)
 0.58A 4pqaA-3gb0A:
35.0		 4pqaA-3gb0A:
25.12
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ic1 SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Haemophilus
influenzae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		8 HIS A  67
ASP A 100
GLU A 134
GLU A 135
GLU A 163
GLY A 323
ASN A 345
ILE A 348
 ZN  A1001 (-3.3A)
ZN  A1001 ( 2.4A)
ZN  A1001 (-3.9A)
ZN  A1002 ( 1.7A)
ZN  A1001 (-2.0A)
SO4  A 378 (-3.9A)
None
None
 0.85A 4pqaA-3ic1A:
49.3		 4pqaA-3ic1A:
54.50
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3ic1 SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Haemophilus
influenzae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		10 HIS A  67
ASP A 100
GLU A 134
GLU A 135
GLU A 163
GLY A 323
GLY A 324
ASN A 345
ILE A 348
HIS A 349
 ZN  A1001 (-3.3A)
ZN  A1001 ( 2.4A)
ZN  A1001 (-3.9A)
ZN  A1002 ( 1.7A)
ZN  A1001 (-2.0A)
SO4  A 378 (-3.9A)
SO4  A 378 (-3.3A)
None
None
ZN  A1002 (-3.4A)
 0.64A 4pqaA-3ic1A:
49.3		 4pqaA-3ic1A:
54.50
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.
3ife PEPTIDASE T

(Bacillus
anthracis) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A  79
ASP A 142
GLU A 176
GLU A 177
HIS A 381
 ZN  A 411 (-3.3A)
ZN  A 411 ( 2.3A)
ZN  A 411 ( 4.0A)
ZN  A 412 (-2.2A)
ZN  A 412 (-3.4A)
 0.26A 4pqaA-3ifeA:
30.4		 4pqaA-3ifeA:
22.89
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.
3iib PEPTIDASE M28

(Shewanella
amazonensis) 		PF04389
(Peptidase_M28) 		6 HIS A 280
ASP A 292
GLU A 326
GLU A 327
GLY A 171
HIS A 425
 ZN  A   2 (-3.3A)
ZN  A   1 ( 2.5A)
ZN  A   2 ( 3.8A)
ZN  A   1 (-2.0A)
None
ZN  A   1 (-3.5A)
 0.68A 4pqaA-3iibA:
19.6		 4pqaA-3iibA:
23.09
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.
3iib PEPTIDASE M28

(Shewanella
amazonensis) 		PF04389
(Peptidase_M28) 		5 HIS A 280
ASP A 292
GLU A 327
GLY A 167
HIS A 425
 ZN  A   2 (-3.3A)
ZN  A   1 ( 2.5A)
ZN  A   1 (-2.0A)
None
ZN  A   1 (-3.5A)
 0.82A 4pqaA-3iibA:
19.6		 4pqaA-3iibA:
23.09
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.
3kl9 GLUTAMYL
AMINOPEPTIDASE

(Streptococcus
pneumoniae) 		PF05343
(Peptidase_M42) 		8 HIS A  66
ASP A 181
GLU A 213
GLU A 214
ARG A 257
GLY A 289
ILE A 317
HIS A 318
 ZN  A 355 (-3.7A)
ZN  A 356 ( 2.4A)
ZN  A 355 (-3.6A)
ZN  A 356 (-2.0A)
None
None
None
ZN  A 356 (-3.5A)
 0.79A 4pqaA-3kl9A:
22.3		 4pqaA-3kl9A:
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.
3kl9 GLUTAMYL
AMINOPEPTIDASE

(Streptococcus
pneumoniae) 		PF05343
(Peptidase_M42) 		8 HIS A  66
ASP A 181
GLU A 213
GLU A 214
GLY A 289
GLY A 291
ILE A 317
HIS A 318
 ZN  A 355 (-3.7A)
ZN  A 356 ( 2.4A)
ZN  A 355 (-3.6A)
ZN  A 356 (-2.0A)
None
None
None
ZN  A 356 (-3.5A)
 0.87A 4pqaA-3kl9A:
22.3		 4pqaA-3kl9A:
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.
3n5f N-CARBAMOYL-L-AMINO
ACID HYDROLASE

(Geobacillus
stearothermophilus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A  79
ASP A  90
GLU A 124
GLU A 125
HIS A 380
 CO  A 410 (-3.2A)
CO  A 410 (-2.8A)
CO  A 410 (-3.3A)
CO  A 410 ( 4.7A)
None
 0.41A 4pqaA-3n5fA:
28.2		 4pqaA-3n5fA:
25.29
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.
3n5f N-CARBAMOYL-L-AMINO
ACID HYDROLASE

(Geobacillus
stearothermophilus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A  79
ASP A  90
GLU A 124
GLY A 353
HIS A 380
 CO  A 410 (-3.2A)
CO  A 410 (-2.8A)
CO  A 410 (-3.3A)
None
None
 0.52A 4pqaA-3n5fA:
28.2		 4pqaA-3n5fA:
25.29
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.
3n5f N-CARBAMOYL-L-AMINO
ACID HYDROLASE

(Geobacillus
stearothermophilus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A  79
ASP A  90
GLU A 125
GLY A 353
HIS A 380
 CO  A 410 (-3.2A)
CO  A 410 (-2.8A)
CO  A 410 ( 4.7A)
None
None
 0.64A 4pqaA-3n5fA:
28.2		 4pqaA-3n5fA:
25.29
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.
3pb9 GLUTAMINYL-PEPTIDE
CYCLOTRANSFERASE-LIK
E PROTEIN

(Homo sapiens) 		PF04389
(Peptidase_M28) 		5 HIS X 168
ASP X 186
GLU X 225
GLU X 226
HIS X 351
 None
ZN  X 400 ( 2.1A)
1BN  X 390 (-3.6A)
ZN  X 400 ( 2.1A)
ZN  X 400 ( 3.2A)
 0.32A 4pqaA-3pb9X:
22.5		 4pqaA-3pb9X:
22.49
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.
3pfe SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Legionella
pneumophila) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		7 HIS A  96
ASP A 129
GLU A 162
GLU A 163
GLY A 411
GLY A 412
HIS A 442
 ZN  A 501 (-3.3A)
ZN  A 502 ( 2.3A)
ZN  A 501 (-3.9A)
ZN  A 502 (-2.0A)
CL  A 505 (-3.8A)
GOL  A 518 (-3.3A)
ZN  A 502 (-3.2A)
 0.52A 4pqaA-3pfeA:
30.1		 4pqaA-3pfeA:
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.
3pfo PUTATIVE
ACETYLORNITHINE
DEACETYLASE

(Rhodopseudomonas
palustris) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		6 HIS A 110
ASP A 143
GLU A 177
GLU A 178
GLU A 201
HIS A 401
 ZN  A 450 (-3.3A)
ZN  A 450 ( 2.5A)
ZN  A 450 (-3.7A)
ZN  A 451 (-2.0A)
ZN  A 450 (-2.0A)
ZN  A 451 (-3.5A)
 0.26A 4pqaA-3pfoA:
36.8		 4pqaA-3pfoA:
26.52
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.
3ram HMRA PROTEIN

(Staphylococcus
aureus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		5 HIS A  95
GLU A 128
GLU A 129
GLY A 313
HIS A 341
 ZN  A 999 (-3.3A)
GOL  A 512 (-3.2A)
ZN  A 998 ( 2.2A)
GOL  A 512 ( 4.4A)
ZN  A 998 (-3.3A)
 0.91A 4pqaA-3ramA:
24.7		 4pqaA-3ramA:
24.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rza TRIPEPTIDASE

(Staphylococcus
aureus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		7 HIS A  79
ASP A 110
GLU A 143
GLU A 144
GLY A 321
GLY A 322
HIS A 347
 ZN  A 401 (-3.3A)
ZN  A 401 ( 2.5A)
ZN  A 401 ( 3.8A)
CA  A 402 (-2.2A)
IPA  A 408 (-3.6A)
CIT  A 407 (-3.5A)
CA  A 402 (-3.4A)
 0.56A 4pqaA-3rzaA:
35.2		 4pqaA-3rzaA:
24.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3rza TRIPEPTIDASE

(Staphylococcus
aureus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		7 HIS A  79
ASP A 110
GLU A 143
GLU A 144
GLY A 322
ILE A 346
HIS A 347
 ZN  A 401 (-3.3A)
ZN  A 401 ( 2.5A)
ZN  A 401 ( 3.8A)
CA  A 402 (-2.2A)
CIT  A 407 (-3.5A)
None
CA  A 402 (-3.4A)
 0.56A 4pqaA-3rzaA:
35.2		 4pqaA-3rzaA:
24.82
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3si1 GLUTAMINYL-PEPTIDE
CYCLOTRANSFERASE

(Mus musculus) 		PF04389
(Peptidase_M28) 		5 HIS A 141
ASP A 160
GLU A 202
GLU A 203
HIS A 331
 None
ZN  A 601 (-2.0A)
None
ZN  A 601 (-2.3A)
ZN  A 601 (-3.6A)
 0.68A 4pqaA-3si1A:
20.5		 4pqaA-3si1A:
20.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3tx8 SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Corynebacterium
glutamicum) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		7 HIS A  77
ASP A 103
GLU A 136
GLU A 137
GLU A 165
GLY A 319
HIS A 345
 None
None
None
None
None
PO4  A 401 (-4.1A)
None
 0.92A 4pqaA-3tx8A:
32.8		 4pqaA-3tx8A:
27.27
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.
3viu PHOSPHORIBOSYLFORMYL
GLYCINAMIDINE
SYNTHASE 2

(Thermus
thermophilus) 		PF00586
(AIRS)
PF02769
(AIRS_C) 		5 GLU A 500
GLY A 531
GLY A 532
ASN A 170
ILE A 535
 None
 0.84A 4pqaA-3viuA:
3.4		 4pqaA-3viuA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4dyo ASPARTYL
AMINOPEPTIDASE

(Homo sapiens) 		PF02127
(Peptidase_M18) 		6 HIS A  94
ASP A 264
GLU A 301
GLU A 302
GLY A 414
HIS A 440
 ZN  A 502 ( 3.4A)
ZN  A 502 (-2.4A)
SD4  A 504 (-2.7A)
ZN  A 501 (-2.0A)
SD4  A 504 (-3.4A)
ZN  A 501 (-3.3A)
 0.41A 4pqaA-4dyoA:
21.6		 4pqaA-4dyoA:
22.18
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4eme M18 ASPARTYL
AMINOPEPTIDASE

(Plasmodium
falciparum) 		PF02127
(Peptidase_M18) 		6 HIS A  87
ASP A 325
GLU A 380
GLU A 381
GLY A 509
HIS A 535
 ZN  A1001 (-3.5A)
ZN  A1002 ( 2.6A)
ZN  A1001 (-3.8A)
ZN  A1002 (-2.1A)
None
ZN  A1002 (-3.4A)
 0.66A 4pqaA-4emeA:
20.9		 4pqaA-4emeA:
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.
4f9u CG32412

(Drosophila
melanogaster) 		PF04389
(Peptidase_M28) 		5 HIS A 114
ASP A 131
GLU A 170
GLU A 171
HIS A 297
 None
ZN  A 401 ( 2.3A)
PBD  A 402 (-3.4A)
ZN  A 401 ( 2.1A)
ZN  A 401 ( 3.1A)
 0.34A 4pqaA-4f9uA:
21.9		 4pqaA-4f9uA:
22.58
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.
4fai CG5976, ISOFORM B

(Drosophila
melanogaster) 		PF04389
(Peptidase_M28) 		5 HIS A 137
ASP A 153
GLU A 190
GLU A 191
HIS A 318
 None
ZN  A 401 ( 2.1A)
PBD  A 402 (-3.5A)
ZN  A 401 ( 2.2A)
ZN  A 401 ( 3.2A)
 0.32A 4pqaA-4faiA:
22.1		 4pqaA-4faiA:
21.12
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4g1p CYS-GLY
METALLODIPEPTIDASE
DUG1

(Saccharomyces
cerevisiae) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		7 HIS A 102
ASP A 137
GLU A 171
GLU A 172
GLY A 420
GLY A 421
HIS A 450
 None
ZN  A 501 (-2.3A)
GLY  A 503 (-3.2A)
ZN  A 501 ( 2.0A)
None
CYS  A 504 ( 4.6A)
ZN  A 501 ( 3.2A)
 0.67A 4pqaA-4g1pA:
31.4		 4pqaA-4g1pA:
23.85
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4h2k SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Haemophilus
influenzae) 		PF01546
(Peptidase_M20) 		8 HIS A  67
ASP A 100
GLU A 134
GLU A 135
GLU A 163
ASN A 234
ILE A 237
HIS A 238
 ZN  A1001 (-3.3A)
ZN  A1001 ( 2.4A)
ZN  A1001 (-3.9A)
ZN  A1002 (-2.0A)
ZN  A1001 (-2.1A)
None
None
ZN  A1002 (-3.4A)
 0.26A 4pqaA-4h2kA:
42.3		 4pqaA-4h2kA:
38.62
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4h2k SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Haemophilus
influenzae) 		PF01546
(Peptidase_M20) 		6 HIS A  67
ASP A 100
GLU A 134
GLU A 135
GLY A 213
ASN A 234
 ZN  A1001 (-3.3A)
ZN  A1001 ( 2.4A)
ZN  A1001 (-3.9A)
ZN  A1002 (-2.0A)
None
None
 1.04A 4pqaA-4h2kA:
42.3		 4pqaA-4h2kA:
38.62
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.
4mhp GLUTAMINYL CYCLASE,
PUTATIVE

(Ixodes
scapularis) 		PF04389
(Peptidase_M28) 		5 HIS A 128
ASP A 144
GLU A 183
GLU A 184
HIS A 322
 None
 0.43A 4pqaA-4mhpA:
21.8		 4pqaA-4mhpA:
22.64
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.
4mmo SSO-CP2
METALLO-CARBOXYPETID
ASE

(Sulfolobus
solfataricus) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		6 HIS A  71
ASP A 104
GLU A 137
GLU A 138
GLU A 163
GLY A 379
 ZN  A 501 (-3.2A)
ZN  A 501 (-2.5A)
ZN  A 501 (-3.4A)
ZN  A 501 ( 4.5A)
ZN  A 501 (-1.7A)
SO4  A 502 (-3.5A)
 0.44A 4pqaA-4mmoA:
35.6		 4pqaA-4mmoA:
25.88
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4op4 SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Vibrio cholerae) 		PF01546
(Peptidase_M20) 		8 HIS A  68
ASP A 101
GLU A 135
GLU A 136
GLU A 164
ASN A 235
ILE A 238
HIS A 239
 ZN  A 303 ( 3.2A)
ZN  A 303 (-2.5A)
EDO  A 311 ( 2.8A)
ZN  A 302 (-1.7A)
ZN  A 303 ( 2.0A)
None
None
ZN  A 302 ( 3.2A)
 0.26A 4pqaA-4op4A:
40.9		 4pqaA-4op4A:
40.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4op4 SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Vibrio cholerae) 		PF01546
(Peptidase_M20) 		6 HIS A  68
ASP A 101
GLU A 135
GLU A 136
GLU A 164
GLY A 213
 ZN  A 303 ( 3.2A)
ZN  A 303 (-2.5A)
EDO  A 311 ( 2.8A)
ZN  A 302 (-1.7A)
ZN  A 303 ( 2.0A)
BU1  A 307 (-4.0A)
 0.78A 4pqaA-4op4A:
40.9		 4pqaA-4op4A:
40.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4op4 SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Vibrio cholerae) 		PF01546
(Peptidase_M20) 		6 HIS A  68
ASP A 101
GLU A 135
GLU A 136
GLY A 213
GLY A 214
 ZN  A 303 ( 3.2A)
ZN  A 303 (-2.5A)
EDO  A 311 ( 2.8A)
ZN  A 302 (-1.7A)
BU1  A 307 (-4.0A)
BU1  A 307 (-4.1A)
 1.10A 4pqaA-4op4A:
40.9		 4pqaA-4op4A:
40.79
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4op4 SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Vibrio cholerae) 		PF01546
(Peptidase_M20) 		7 HIS A  68
ASP A 101
GLU A 135
GLU A 136
GLY A 214
ASN A 235
ILE A 238
 ZN  A 303 ( 3.2A)
ZN  A 303 (-2.5A)
EDO  A 311 ( 2.8A)
ZN  A 302 (-1.7A)
BU1  A 307 (-4.1A)
None
None
 0.92A 4pqaA-4op4A:
40.9		 4pqaA-4op4A:
40.79
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.
4p6y AMINOPEPTIDASE

(Thermotoga
maritima) 		PF05343
(Peptidase_M42) 		6 HIS A  60
ASP A 168
GLU A 197
GLU A 198
GLY A 280
HIS A 307
 None
 0.72A 4pqaA-4p6yA:
23.8		 4pqaA-4p6yA:
23.53
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
4ppz SUCCINYL-DIAMINOPIME
LATE DESUCCINYLASE

(Neisseria
meningitidis) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		11 HIS A  68
ASP A 101
GLU A 135
GLU A 136
GLU A 164
ARG A 179
GLY A 324
GLY A 325
ASN A 346
ILE A 349
HIS A 350
 ZN  A 601 (-3.2A)
ZN  A 601 ( 2.3A)
ZN  A 601 (-3.9A)
ZN  A 602 ( 1.9A)
ZN  A 601 (-2.1A)
None
None
PO4  A 603 ( 3.7A)
None
None
ZN  A 602 (-3.3A)
 0.18A 4pqaA-4ppzA:
60.3		 4pqaA-4ppzA:
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.
4pxd ALLANTOATE
AMIDOHYDROLASE

(Escherichia
coli) 		PF01546
(Peptidase_M20) 		5 HIS A  81
ASP A  92
GLU A 127
GLY A 355
HIS A 382
 None
MN  A 501 ( 2.2A)
MN  A 501 ( 2.0A)
None
MN  A 501 ( 3.3A)
 0.55A 4pqaA-4pxdA:
27.6		 4pqaA-4pxdA:
24.04
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.
4q7a N-ACETYL-ORNITHINE/N
-ACETYL-LYSINE
DEACETYLASE

(Sphaerobacter
thermophilus) 		PF01546
(Peptidase_M20) 		7 HIS A  71
ASP A  95
GLU A 126
GLU A 127
GLU A 151
GLY A 302
HIS A 329
 None
None
None
None
None
SO4  A 401 (-3.2A)
None
 0.68A 4pqaA-4q7aA:
34.5		 4pqaA-4q7aA:
26.28
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.
4r85 CYTOSINE DEAMINASE

(Klebsiella
pneumoniae) 		PF07969
(Amidohydro_3) 		5 HIS A 241
ASP A 308
GLU A 212
GLY A  79
HIS A  58
 FE2  A 502 ( 3.7A)
FE2  A 502 ( 2.8A)
17E  A 501 (-2.9A)
None
FE2  A 502 ( 3.5A)
 0.91A 4pqaA-4r85A:
undetectable		 4pqaA-4r85A:
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.
4r8f VACUOLAR
AMINOPEPTIDASE 1

(Saccharomyces
cerevisiae) 		PF02127
(Peptidase_M18) 		5 HIS A  88
ASP A 259
GLU A 295
GLU A 296
HIS A 435
 None
 0.43A 4pqaA-4r8fA:
20.3		 4pqaA-4r8fA:
23.94
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4ruh CYTOSOLIC
NON-SPECIFIC
DIPEPTIDASE

(Homo sapiens) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		7 HIS A  99
ASP A 132
GLU A 166
GLU A 167
GLY A 415
GLY A 416
HIS A 445
 MN  A 502 ( 3.6A)
MN  A 503 (-2.4A)
BES  A 501 (-2.9A)
MN  A 503 (-1.9A)
None
BES  A 501 (-3.6A)
MN  A 503 ( 3.3A)
 0.64A 4pqaA-4ruhA:
33.6		 4pqaA-4ruhA:
25.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4twe N-ACETYLATED-ALPHA-L
INKED ACIDIC
DIPEPTIDASE-LIKE
PROTEIN

(Homo sapiens) 		PF02225
(PA)
PF04253
(TFR_dimer)
PF04389
(Peptidase_M28) 		5 HIS A 368
ASP A 378
GLU A 416
GLU A 417
HIS A 545
 ZN  A 802 (-3.2A)
ZN  A 802 ( 2.5A)
ZN  A 802 ( 3.9A)
ZN  A 801 (-1.8A)
ZN  A 801 (-3.2A)
 0.34A 4pqaA-4tweA:
18.9		 4pqaA-4tweA:
20.46
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.
4wjb PUTATIVE
AMIDOHYDROLASE/PEPTI
DASE

(Burkholderia
cenocepacia) 		PF01546
(Peptidase_M20)
PF07687
(M20_dimer) 		6 HIS A  88
ASP A  99
GLU A 133
GLU A 134
GLY A 360
HIS A 387
 ZN  A 501 (-3.3A)
ZN  A 501 (-1.8A)
ZN  A 501 ( 4.1A)
ZN  A 501 (-1.8A)
None
ZN  A 501 (-2.8A)
 0.59A 4pqaA-4wjbA:
29.3		 4pqaA-4wjbA:
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.
4wwv AMINOPEPTIDASE FROM
FAMILY M42

(Desulfurococcus
amylolyticus) 		PF05343
(Peptidase_M42) 		7 HIS A  70
ASP A 184
GLU A 214
GLU A 215
GLY A 267
GLY A 302
HIS A 329
 None
 1.25A 4pqaA-4wwvA:
23.3		 4pqaA-4wwvA:
23.78
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.
4wwv AMINOPEPTIDASE FROM
FAMILY M42

(Desulfurococcus
amylolyticus) 		PF05343
(Peptidase_M42) 		8 HIS A  70
ASP A 184
GLU A 214
GLU A 215
GLY A 301
GLY A 302
ILE A 328
HIS A 329
 None
 0.84A 4pqaA-4wwvA:
23.3		 4pqaA-4wwvA:
23.78
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.
4x8i LYSYL AMINOPEPTIDASE

(Pyrococcus
furiosus) 		PF05343
(Peptidase_M42) 		5 HIS A  63
ASP A 177
GLU A 207
GLU A 208
HIS A 314
 ZN  A 401 (-3.3A)
ZN  A 401 ( 2.6A)
CL  A 403 ( 2.8A)
CO  A 402 (-1.8A)
CO  A 402 (-3.5A)
 0.51A 4pqaA-4x8iA:
23.1		 4pqaA-4x8iA:
22.17
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.
4yu9 GLUTAMINYL-PEPTIDE
CYCLOTRANSFERASE

(Homo sapiens) 		PF04389
(Peptidase_M28) 		5 HIS A 140
ASP A 159
GLU A 201
GLU A 202
HIS A 330
 None
ZN  A 401 (-2.1A)
ZN  A 401 ( 4.9A)
ZN  A 401 (-2.2A)
ZN  A 401 (-3.2A)
 0.36A 4pqaA-4yu9A:
21.1		 4pqaA-4yu9A:
21.88
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.
5ds0 PEPTIDASE M42

(Thaumarchaeota
archaeon SCGC
AB-539-E09) 		PF05343
(Peptidase_M42) 		9 HIS A  66
ASP A 180
GLU A 214
GLU A 215
GLU A 237
GLY A 297
GLY A 298
ILE A 324
HIS A 325
 CO  A 402 (-3.2A)
CO  A 401 ( 2.3A)
CO  A 402 (-3.4A)
CO  A 401 (-2.0A)
CO  A 402 (-2.0A)
None
None
None
CO  A 401 (-3.3A)
 0.86A 4pqaA-5ds0A:
24.5		 4pqaA-5ds0A:
25.42
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.
5gne LEUCINE
AMINOPEPTIDASE

(Legionella
pneumophila) 		PF04389
(Peptidase_M28) 		6 HIS A 213
ASP A 226
GLU A 260
GLU A 261
ASN A 362
HIS A 366
 ZN  A 402 (-3.4A)
ZN  A 402 ( 2.8A)
ZN  A 402 ( 3.7A)
ZN  A 401 (-2.6A)
None
ZN  A 401 (-3.7A)
 1.23A 4pqaA-5gneA:
24.0		 4pqaA-5gneA:
23.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5gne LEUCINE
AMINOPEPTIDASE

(Legionella
pneumophila) 		PF04389
(Peptidase_M28) 		5 HIS A 213
GLU A 260
GLU A 261
GLY A 334
HIS A 366
 ZN  A 402 (-3.4A)
ZN  A 402 ( 3.7A)
ZN  A 401 (-2.6A)
None
ZN  A 401 (-3.7A)
 0.82A 4pqaA-5gneA:
24.0		 4pqaA-5gneA:
23.34
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5jm6 AMINOPEPTIDASE-LIKE
PROTEIN

(Chaetomium
thermophilum) 		PF02127
(Peptidase_M18) 		5 HIS A 133
ASP A 306
GLU A 339
GLU A 340
HIS A 485
 ZN  A 602 (-3.3A)
ZN  A 601 ( 2.1A)
ZN  A 602 (-3.5A)
ZN  A 601 (-1.8A)
ZN  A 601 (-3.0A)
 0.52A 4pqaA-5jm6A:
19.5		 4pqaA-5jm6A:
22.57
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5thw DEACYLASE

(Burkholderia
multivorans) 		PF01546
(Peptidase_M20) 		5 HIS A  96
ASP A 107
GLU A 141
GLU A 142
HIS A 395
 ZN  A 501 ( 3.5A)
ZN  A 502 (-2.4A)
URP  A 503 ( 2.9A)
ZN  A 502 ( 2.1A)
ZN  A 502 ( 3.3A)
 0.39A 4pqaA-5thwA:
28.2		 4pqaA-5thwA:
23.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5thw DEACYLASE

(Burkholderia
multivorans) 		PF01546
(Peptidase_M20) 		5 HIS A  96
ASP A 107
GLU A 142
GLY A 368
HIS A 395
 ZN  A 501 ( 3.5A)
ZN  A 502 (-2.4A)
ZN  A 502 ( 2.1A)
None
ZN  A 502 ( 3.3A)
 0.64A 4pqaA-5thwA:
28.2		 4pqaA-5thwA:
23.61
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5xoy [LYSW]-LYSINE
HYDROLASE

(Thermus
thermophilus) 		PF01546
(Peptidase_M20) 		7 HIS A  67
ASP A  91
GLU A 124
GLU A 125
GLU A 148
GLY A 299
HIS A 326
 None
None
LYS  A 401 (-3.0A)
LYS  A 401 (-3.7A)
None
LYS  A 401 ( 4.1A)
None
 0.61A 4pqaA-5xoyA:
33.4		 4pqaA-5xoyA:
26.29
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.
6c0d AMIDASE,
HYDANTOINASE/CARBAMO
YLASE FAMILY

(Paraburkholderia
phymatum) 		no annotation 5 HIS A  81
ASP A  92
GLU A 126
GLU A 127
GLY A 356
 ZN  A 501 (-3.3A)
ZN  A 501 (-2.8A)
ZN  A 501 ( 4.0A)
ZN  A 501 ( 4.9A)
None
 0.50A 4pqaA-6c0dA:
28.5		 4pqaA-6c0dA:
13.37
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6esl BACTERIAL LEUCYL
AMINOPEPTIDASE

(Legionella
pneumophila) 		no annotation 5 HIS A 194
ASP A 207
GLU A 241
GLU A 242
GLY A 315
 ZN  A 402 (-3.3A)
ZN  A 402 ( 2.2A)
ZN  A 402 ( 4.2A)
ZN  A 401 (-2.3A)
None
 0.79A 4pqaA-6eslA:
23.7		 4pqaA-6eslA:
11.51
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.
6esl BACTERIAL LEUCYL
AMINOPEPTIDASE

(Legionella
pneumophila) 		no annotation 6 HIS A 194
ASP A 207
GLU A 241
GLU A 242
ILE A 346
HIS A 347
 ZN  A 402 (-3.3A)
ZN  A 402 ( 2.2A)
ZN  A 402 ( 4.2A)
ZN  A 401 (-2.3A)
None
ZN  A 401 (-3.8A)
 0.42A 4pqaA-6eslA:
23.7		 4pqaA-6eslA:
11.51
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.
6esl BACTERIAL LEUCYL
AMINOPEPTIDASE

(Legionella
pneumophila) 		no annotation 6 HIS A 194
ASP A 207
GLU A 242
ASN A 343
ILE A 346
HIS A 347
 ZN  A 402 (-3.3A)
ZN  A 402 ( 2.2A)
ZN  A 401 (-2.3A)
None
None
ZN  A 401 (-3.8A)
 1.47A 4pqaA-6eslA:
23.7		 4pqaA-6eslA:
11.51