SIMILAR PATTERNS OF AMINO ACIDS FOR 6B68_D_9F2D400_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.
1alq CP254 BETA-LACTAMASE

(Staphylococcus
aureus)
PF13354
(Beta-lactamase2)
5 SER A  70
SER A 130
ASN A 170
LYS A 234
GLY A 236
None
0.42A 6b68D-1alqA:
27.8
6b68D-1alqA:
15.09
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.
1bsg BETA LACTAMASE

(Streptomyces
albus)
PF13354
(Beta-lactamase2)
8 SER A  70
SER A 130
ASN A 170
THR A 216
ARG A 220
LYS A 234
GLY A 236
GLY A 238
None
0.58A 6b68D-1bsgA:
41.7
6b68D-1bsgA:
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.
1bue PROTEIN
(IMIPENEM-HYDROLYSIN
G BETA-LACTAMASE)


(Enterobacter
cloacae)
PF13354
(Beta-lactamase2)
7 SER A  70
SER A 130
ASN A 170
THR A 216
ARG A 220
LYS A 234
GLY A 236
None
0.37A 6b68D-1bueA:
38.5
6b68D-1bueA:
16.27
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.
1dy6 CARBAPENEM-HYDROLYSI
NG BETA-LACTAMASE
SME-1


(Serratia
marcescens)
PF13354
(Beta-lactamase2)
6 SER A  70
SER A 130
ASN A 170
THR A 216
ARG A 220
GLY A 239
None
0.89A 6b68D-1dy6A:
38.9
6b68D-1dy6A:
16.09
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.
1dy6 CARBAPENEM-HYDROLYSI
NG BETA-LACTAMASE
SME-1


(Serratia
marcescens)
PF13354
(Beta-lactamase2)
7 SER A  70
SER A 130
ASN A 170
THR A 216
ARG A 220
LYS A 234
GLY A 236
None
0.42A 6b68D-1dy6A:
38.9
6b68D-1dy6A:
16.09
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.
1e25 EXTENDED-SPECTRUM
BETA-LACTAMASE PER-1


(Pseudomonas
aeruginosa)
PF13354
(Beta-lactamase2)
8 SER A  70
SER A 130
THR A 216
ARG A 220
LYS A 234
GLY A 236
THR A 237
GLU A 276
SO4  A 500 (-3.1A)
SO4  A 500 (-2.6A)
SO4  A 500 ( 4.0A)
SO4  A 500 ( 4.2A)
SO4  A 500 (-3.2A)
SO4  A 500 (-3.5A)
SO4  A 500 (-3.5A)
None
0.45A 6b68D-1e25A:
31.4
6b68D-1e25A:
11.35
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1g68 BETA-LACTAMASE PSE-4

(Pseudomonas
aeruginosa)
PF13354
(Beta-lactamase2)
5 SER A  70
SER A 130
ASN A 170
GLY A 236
GLY A 238
SO4  A 400 (-2.9A)
SO4  A 400 (-2.7A)
None
SO4  A 400 (-3.0A)
None
0.62A 6b68D-1g68A:
37.1
6b68D-1g68A:
15.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1hzo BETA-LACTAMASE

(Proteus
vulgaris)
PF13354
(Beta-lactamase2)
8 SER A  70
SER A 130
ASN A 170
THR A 216
LYS A 234
GLY A 236
GLY A 238
ASP A 240
MES  A1000 (-3.1A)
MES  A1000 (-2.7A)
None
MES  A1000 (-3.7A)
MES  A1000 (-2.9A)
MES  A1000 (-3.1A)
None
None
0.51A 6b68D-1hzoA:
41.3
6b68D-1hzoA:
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.
1i2w BETA-LACTAMASE

(Bacillus
licheniformis)
PF13354
(Beta-lactamase2)
6 SER A  70
SER A 130
THR A 216
LYS A 234
GLY A 236
GLY A 238
CFX  A1300 (-1.3A)
CFX  A1300 (-3.1A)
CFX  A1300 (-3.2A)
CFX  A1300 ( 3.9A)
CFX  A1300 (-3.3A)
CFX  A1300 ( 4.1A)
0.42A 6b68D-1i2wA:
41.8
6b68D-1i2wA:
17.48
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.
1j9m DD-TRANSPEPTIDASE

(Streptomyces
sp. K15)
PF00768
(Peptidase_S11)
6 SER A  35
SER A  96
THR A 199
ARG A 248
LYS A 213
GLY A 215
NA  A 600 (-3.3A)
NA  A 600 (-3.1A)
NA  A 600 ( 4.5A)
CL  A 601 (-3.1A)
NA  A 600 (-3.4A)
NA  A 600 ( 3.6A)
0.89A 6b68D-1j9mA:
22.5
6b68D-1j9mA:
17.05
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.
1j9m DD-TRANSPEPTIDASE

(Streptomyces
sp. K15)
PF00768
(Peptidase_S11)
6 SER A  96
THR A 199
ARG A 248
LYS A 213
GLY A 215
GLY A 217
NA  A 600 (-3.1A)
NA  A 600 ( 4.5A)
CL  A 601 (-3.1A)
NA  A 600 (-3.4A)
NA  A 600 ( 3.6A)
None
0.67A 6b68D-1j9mA:
22.5
6b68D-1j9mA:
17.05
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.
1n4o L2 BETA-LACTAMASE

(Stenotrophomonas
maltophilia)
PF13354
(Beta-lactamase2)
6 SER A  70
SER A 130
ASN A 170
THR A 216
LYS A 234
GLY A 236
SO4  A1002 (-2.9A)
SO4  A1002 (-3.1A)
None
SO4  A1002 ( 4.8A)
SO4  A1002 (-3.6A)
SO4  A1002 (-3.2A)
0.32A 6b68D-1n4oA:
37.6
6b68D-1n4oA:
17.72
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1n9b BETA-LACTAMASE SHV-2

(Klebsiella
pneumoniae)
PF13354
(Beta-lactamase2)
5 SER A  70
SER A 130
ASN A 170
LYS A 234
GLY A 236
EPE  A 400 (-3.7A)
EPE  A 400 (-2.5A)
None
EPE  A 400 (-3.1A)
EPE  A 400 (-3.1A)
0.69A 6b68D-1n9bA:
34.1
6b68D-1n9bA:
17.12
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.
1nrf REGULATORY PROTEIN
BLAR1


(Bacillus
licheniformis)
PF00905
(Transpeptidase)
5 SER A 402
SER A 450
LYS A 539
GLY A 541
THR A 542
None
0.49A 6b68D-1nrfA:
18.9
6b68D-1nrfA:
14.34
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.
1w5d PENICILLIN-BINDING
PROTEIN


(Bacillus
subtilis)
PF02113
(Peptidase_S13)
5 SER A  52
SER A 299
THR A 394
LYS A 411
GLY A 413
None
0.35A 6b68D-1w5dA:
20.2
6b68D-1w5dA:
11.48
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.
1xp4 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE


(Streptococcus
pneumoniae)
PF00768
(Peptidase_S11)
PF07943
(PBP5_C)
8 SER A  56
SER A 119
THR A 221
ARG A 278
LYS A 239
GLY A 241
THR A 242
ASP A 244
SO4  A 464 (-3.4A)
SO4  A 464 (-3.4A)
SO4  A 464 ( 4.0A)
SO4  A 464 ( 4.1A)
SO4  A 464 (-3.5A)
SO4  A 464 ( 3.8A)
SO4  A 464 (-4.0A)
None
0.62A 6b68D-1xp4A:
20.5
6b68D-1xp4A:
13.98
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.
1zg4 BETA-LACTAMASE TEM

(Escherichia
coli)
PF13354
(Beta-lactamase2)
6 SER A  70
SER A 130
ASN A 170
LYS A 234
GLY A 236
GLY A 238
None
0.32A 6b68D-1zg4A:
36.7
6b68D-1zg4A:
14.69
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2c6w PENICILLIN-BINDING
PROTEIN 1A


(Streptococcus
pneumoniae)
PF00905
(Transpeptidase)
5 SER B 370
SER B 428
THR B 543
LYS B 557
GLY B 559
CL  B 704 (-3.5A)
CL  B 704 (-3.4A)
CL  B 704 ( 4.8A)
None
CL  B 704 ( 4.0A)
0.68A 6b68D-2c6wB:
16.5
6b68D-2c6wB:
12.46
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.
2c6w PENICILLIN-BINDING
PROTEIN 1A


(Streptococcus
pneumoniae)
PF00905
(Transpeptidase)
5 SER B 428
THR B 543
LYS B 557
GLY B 559
THR B 560
CL  B 704 (-3.4A)
CL  B 704 ( 4.8A)
None
CL  B 704 ( 4.0A)
CL  B 704 ( 4.8A)
0.69A 6b68D-2c6wB:
16.5
6b68D-2c6wB:
12.46
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.
2cc1 BETA-LACTAMASE

(Mycolicibacterium
fortuitum)
PF13354
(Beta-lactamase2)
8 SER A  70
SER A 130
ASN A 170
THR A 216
LYS A 234
GLY A 236
GLY A 238
ASP A 240
None
0.36A 6b68D-2cc1A:
39.4
6b68D-2cc1A:
16.79
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.
2fff PENICILLIN-BINDING
PROTEIN 1B


(Streptococcus
pneumoniae)
PF00905
(Transpeptidase)
6 SER B 460
SER B 516
THR B 629
LYS B 651
GLY B 653
THR B 654
None
0.54A 6b68D-2fffB:
16.3
6b68D-2fffB:
9.71
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.
2iwb METHICILLIN
RESISTANCE MECR1
PROTEIN


(Staphylococcus
aureus)
PF00905
(Transpeptidase)
6 SER A 391
SER A 439
LYS A 528
GLY A 530
THR A 531
GLY A 532
GOL  A 604 ( 2.7A)
GOL  A 604 (-2.6A)
GOL  A 604 (-2.9A)
GOL  A 605 ( 3.2A)
GOL  A 604 ( 3.6A)
None
0.38A 6b68D-2iwbA:
18.9
6b68D-2iwbA:
17.83
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.
2jch PENICILLIN-BINDING
PROTEIN 1B


(Streptococcus
pneumoniae)
PF00905
(Transpeptidase)
PF00912
(Transgly)
6 SER A 460
SER A 516
THR A 629
LYS A 651
GLY A 653
THR A 654
PL7  A1793 (-1.4A)
PL7  A1793 (-3.0A)
PL7  A1793 ( 4.1A)
PL7  A1793 ( 4.1A)
PL7  A1793 (-3.3A)
PL7  A1793 (-4.1A)
0.56A 6b68D-2jchA:
15.3
6b68D-2jchA:
8.06
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.
2v2f PENICILLIN BINDING
PROTEIN 1A


(Streptococcus
pneumoniae)
PF00905
(Transpeptidase)
5 SER F 428
THR F 543
LYS F 557
GLY F 559
THR F 560
MES  F1653 (-3.1A)
MES  F1653 (-3.7A)
MES  F1653 ( 4.0A)
MES  F1653 (-3.6A)
MES  F1653 (-3.6A)
0.64A 6b68D-2v2fF:
17.5
6b68D-2v2fF:
12.50
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.
2wae PENICILLIN-BINDING
PROTEIN 2B


(Streptococcus
pneumoniae)
PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
5 SER A 386
SER A 443
THR A 600
LYS A 615
GLY A 617
None
0.50A 6b68D-2waeA:
15.6
6b68D-2waeA:
8.60
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2wuq BETA-LACTAMASE
REGULATORY PROTEIN
BLAB


(Streptomyces
cacaoi)
PF13354
(Beta-lactamase2)
7 SER A  47
SER A 109
ARG A 239
LYS A 254
GLY A 256
THR A 257
GLU A 295
None
0.57A 6b68D-2wuqA:
29.0
6b68D-2wuqA:
14.55
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.
2wyx BETA-LACTAMSE TOHO-1

(Escherichia
coli)
PF13354
(Beta-lactamase2)
8 SER A  70
SER A 130
ASN A 170
THR A 216
LYS A 234
GLY A 236
GLY A 238
ASP A 240
None
0.52A 6b68D-2wyxA:
40.6
6b68D-2wyxA:
18.53
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.
2z2m PENICILLIN-BINDING
PROTEIN 2X


(Streptococcus
pneumoniae)
PF00905
(Transpeptidase)
6 SER B 337
SER B 395
THR B 526
LYS B 547
GLY B 549
THR B 550
CDS  B 901 ( 1.3A)
CDS  B 901 ( 3.2A)
CDS  B 901 ( 4.1A)
CDS  B 901 ( 3.9A)
CDS  B 901 ( 3.4A)
CDS  B 901 ( 3.6A)
0.40A 6b68D-2z2mB:
16.1
6b68D-2z2mB:
13.87
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.
3a3i PENICILLIN-BINDING
PROTEIN 4


(Haemophilus
influenzae)
PF02113
(Peptidase_S13)
5 SER A  69
SER A 310
THR A 401
LYS A 420
GLY A 422
AIX  A 501 (-1.3A)
AIX  A 501 (-2.8A)
AIX  A 501 ( 4.0A)
AIX  A 501 ( 3.8A)
AIX  A 501 (-3.4A)
0.37A 6b68D-3a3iA:
20.1
6b68D-3a3iA:
12.53
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.
3bfg CLASS A
BETA-LACTAMASE SED1


(Citrobacter
sedlakii)
PF13354
(Beta-lactamase2)
7 SER A  70
SER A 130
ASN A 170
THR A 216
LYS A 234
GLY A 236
ASP A 240
MER  A 301 (-1.3A)
MER  A 301 (-2.6A)
MER  A 301 (-2.6A)
MER  A 301 (-3.6A)
MER  A 301 (-3.2A)
MER  A 301 (-3.0A)
None
0.64A 6b68D-3bfgA:
41.0
6b68D-3bfgA:
18.10
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.
3byd BETA-LACTAMASE OXY-1

(Klebsiella
oxytoca)
PF13354
(Beta-lactamase2)
8 SER A  73
SER A 133
ASN A 173
THR A 219
LYS A 237
GLY A 239
GLY A 241
ASP A 242
SO4  A 301 (-2.9A)
SO4  A 301 (-2.8A)
None
SO4  A 301 ( 4.0A)
SO4  A 301 (-3.1A)
SO4  A 301 (-3.3A)
None
None
0.45A 6b68D-3bydA:
41.5
6b68D-3bydA:
19.09
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.
3cjm PUTATIVE
BETA-LACTAMASE


(Enterococcus
faecalis)
PF13354
(Beta-lactamase2)
6 SER A 108
SER A 169
ARG A 244
LYS A 257
GLY A 259
ASP A 262
NO3  A   1 (-2.9A)
None
EDO  A   6 ( 4.5A)
None
None
None
0.59A 6b68D-3cjmA:
26.0
6b68D-3cjmA:
13.86
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3dwk PENICILLIN-BINDING
PROTEIN 2


(Staphylococcus
aureus)
PF00905
(Transpeptidase)
PF00912
(Transgly)
5 SER A 454
LYS A 583
GLY A 585
THR A 586
GLY A 587
SO4  A  26 (-3.1A)
SO4  A  26 ( 4.2A)
SO4  A  26 (-3.3A)
SO4  A  26 (-3.5A)
None
0.53A 6b68D-3dwkA:
17.8
6b68D-3dwkA:
8.84
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
3dwz BETA-LACTAMASE

(Mycobacterium
tuberculosis)
PF13354
(Beta-lactamase2)
11 SER A  84
SER A 142
ASN A 186
THR A 232
ARG A 236
LYS A 250
GLY A 252
THR A 253
GLY A 254
ASP A 255
GLU A 292
DWZ  A 400 (-1.3A)
DWZ  A 400 (-2.7A)
DWZ  A 400 ( 4.0A)
DWZ  A 400 ( 4.5A)
DWZ  A 400 ( 4.3A)
DWZ  A 400 ( 3.8A)
DWZ  A 400 (-3.3A)
DWZ  A 400 (-4.1A)
None
None
None
0.33A 6b68D-3dwzA:
48.5
6b68D-3dwzA:
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.
3hum PENICILLIN-BINDING
PROTEIN 4


(Staphylococcus
aureus)
PF00768
(Peptidase_S11)
PF09211
(DUF1958)
6 SER A  75
SER A 139
LYS A 259
GLY A 261
ASP A 264
GLU A 297
CEW  A 501 (-2.6A)
CEW  A 501 (-3.4A)
CEW  A 501 ( 4.4A)
CEW  A 501 (-3.1A)
None
CEW  A 501 (-3.2A)
0.72A 6b68D-3humA:
22.5
6b68D-3humA:
11.70
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.
3lez BETA-LACTAMASE

(Oceanobacillus
iheyensis)
PF13354
(Beta-lactamase2)
6 SER A  85
ASN A 183
THR A 229
LYS A 247
GLY A 249
GLY A 251
EPE  A 305 (-3.4A)
None
EPE  A 305 ( 3.9A)
EPE  A 305 (-3.1A)
EPE  A 305 (-3.4A)
None
0.41A 6b68D-3lezA:
40.7
6b68D-3lezA:
18.97
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3p09 BETA-LACTAMASE

(Francisella
tularensis)
PF13354
(Beta-lactamase2)
9 SER A  61
SER A 122
ASN A 162
THR A 208
ARG A 212
LYS A 226
GLY A 228
THR A 229
GLU A 268
SO4  A 288 (-3.1A)
SO4  A 288 (-2.7A)
None
SO4  A 288 ( 4.8A)
SO4  A 288 ( 4.4A)
SO4  A 288 (-3.5A)
SO4  A 288 (-3.3A)
SO4  A 288 (-3.4A)
None
0.33A 6b68D-3p09A:
39.3
6b68D-3p09A:
25.37
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.
3q7z BETA-LACTAMASE
REGULATORY PROTEIN
BLAR1


(Staphylococcus
aureus)
PF00905
(Transpeptidase)
6 SER A 389
SER A 437
LYS A 526
GLY A 528
THR A 529
GLY A 530
BOU  A 584 (-1.4A)
BOU  A 584 (-2.8A)
BOU  A 584 (-3.3A)
BOU  A 584 (-3.7A)
BOU  A 584 (-3.6A)
BOU  A 584 ( 3.9A)
0.43A 6b68D-3q7zA:
17.7
6b68D-3q7zA:
14.22
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.
3qhy BETA-LACTAMASE

(Bacillus
anthracis)
PF13354
(Beta-lactamase2)
7 SER A  70
SER A 130
ASN A 170
THR A 216
LYS A 234
GLY A 236
GLY A 238
None
0.34A 6b68D-3qhyA:
41.7
6b68D-3qhyA:
23.04
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.
3qnb OXACILLINASE

(Escherichia
coli)
PF00905
(Transpeptidase)
6 SER A  67
SER A 115
ARG A 250
LYS A 205
GLY A 207
GLY A 209
KCX  A  70 ( 2.7A)
KCX  A  70 ( 4.6A)
SO4  A   4 (-3.4A)
KCX  A  70 ( 4.7A)
None
None
0.97A 6b68D-3qnbA:
18.7
6b68D-3qnbA:
14.34
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.
3ue1 PENICILLIN-BINDING
PROTEIN 1A


(Acinetobacter
baumannii)
PF00905
(Transpeptidase)
PF00912
(Transgly)
PF17092
(PCB_OB)
5 SER A 434
SER A 487
LYS A 669
GLY A 671
THR A 672
UE1  A 998 (-1.7A)
UE1  A 998 (-3.3A)
UE1  A 998 ( 3.8A)
UE1  A 998 (-3.4A)
UE1  A 998 (-3.6A)
0.70A 6b68D-3ue1A:
14.7
6b68D-3ue1A:
7.87
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.
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE


(Bdellovibrio
bacteriovorus)
PF02113
(Peptidase_S13)
5 SER A  70
SER A 251
THR A 342
LYS A 357
GLY A 359
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
None
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.29A 6b68D-3v39A:
17.0
6b68D-3v39A:
11.89
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.
3vsk PENICILLIN-BINDING
PROTEIN 3


(Staphylococcus
aureus)
PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
5 SER A 392
SER A 448
THR A 603
LYS A 618
GLY A 620
None
0.50A 6b68D-3vskA:
17.0
6b68D-3vskA:
9.00
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.
3w4q BETA-LACTAMASE

(Burkholderia
multivorans)
PF13354
(Beta-lactamase2)
9 SER A  70
SER A 130
ASN A 170
ARG A 220
LYS A 234
GLY A 236
THR A 237
GLY A 238
ASP A 240
None
0.36A 6b68D-3w4qA:
41.2
6b68D-3w4qA:
17.18
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.
3zdj ENCA BETA-LACTAMASE

(synthetic
construct)
PF13354
(Beta-lactamase2)
6 SER A  70
SER A 130
ASN A 170
LYS A 234
GLY A 236
GLY A 238
SO4  A1291 (-3.4A)
SO4  A1291 (-3.1A)
None
SO4  A1291 (-3.3A)
SO4  A1291 (-3.3A)
None
0.30A 6b68D-3zdjA:
36.8
6b68D-3zdjA:
15.09
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.
3zg8 PENICILLIN-BINDING
PROTEIN 4


(Listeria
monocytogenes)
PF00905
(Transpeptidase)
PF00912
(Transgly)
5 SER B 394
SER B 449
THR B 561
LYS B 575
GLY B 577
AIX  B 800 (-0.2A)
AIX  B 800 (-2.4A)
AIX  B 800 ( 3.8A)
AIX  B 800 ( 4.0A)
AIX  B 800 ( 3.7A)
0.41A 6b68D-3zg8B:
16.4
6b68D-3zg8B:
9.30
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.
3zny CTX-M-12A ENZYME

(Klebsiella
pneumoniae)
PF13354
(Beta-lactamase2)
7 SER A  70
SER A 130
ASN A 170
THR A 216
LYS A 234
GLY A 236
GLY A 238
None
0.47A 6b68D-3znyA:
41.5
6b68D-3znyA:
22.93
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.
3zvt D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE


(Actinomadura
sp. R39)
PF02113
(Peptidase_S13)
5 SER A  49
SER A 298
THR A 393
LYS A 410
GLY A 412
B07  A 500 (-1.4A)
B07  A 500 (-1.4A)
B07  A 500 ( 4.8A)
B07  A 500 (-1.6A)
B07  A 500 (-3.2A)
0.63A 6b68D-3zvtA:
20.2
6b68D-3zvtA:
10.47
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.
4c6y BETA-LACTAMASE

(synthetic
construct)
PF13354
(Beta-lactamase2)
9 SER A  70
SER A 130
ASN A 170
THR A 216
ARG A 220
LYS A 234
GLY A 236
THR A 237
GLY A 238
PEG  A 307 (-2.4A)
PEG  A 307 (-2.4A)
PEG  A 307 ( 4.3A)
PEG  A 307 ( 4.3A)
PEG  A 307 ( 3.6A)
PEG  A 307 ( 3.4A)
PEG  A 307 (-2.7A)
PEG  A 307 (-3.9A)
None
0.31A 6b68D-4c6yA:
40.4
6b68D-4c6yA:
25.82
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.
4c75 BETA-LACTAMASE

(synthetic
construct)
PF13354
(Beta-lactamase2)
8 SER A  70
SER A 130
ASN A 170
THR A 216
LYS A 234
GLY A 236
THR A 237
GLY A 238
NA  A 294 ( 2.5A)
SO4  A 291 (-2.8A)
None
SO4  A 291 ( 4.1A)
SO4  A 291 (-3.4A)
NA  A 294 ( 3.2A)
SO4  A 291 ( 3.4A)
None
0.42A 6b68D-4c75A:
40.3
6b68D-4c75A:
24.39
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.
4d2o PER-2 BETA-LACTAMASE

(Citrobacter
freundii)
PF13354
(Beta-lactamase2)
7 ARG A 240
THR A 216
ARG A 220
LYS A 234
GLY A 236
THR A 237
GLU A 276
None
1.14A 6b68D-4d2oA:
31.1
6b68D-4d2oA:
13.73
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.
4d2o PER-2 BETA-LACTAMASE

(Citrobacter
freundii)
PF13354
(Beta-lactamase2)
8 SER A  70
SER A 130
THR A 216
ARG A 220
LYS A 234
GLY A 236
THR A 237
GLU A 276
None
0.57A 6b68D-4d2oA:
31.1
6b68D-4d2oA:
13.73
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.
4ev4 CARBAPENEM-HYDROLIZI
NG BETA-LACTAMASE
SFC-1


(Serratia
fonticola)
PF13354
(Beta-lactamase2)
8 SER A  70
SER A 130
ASN A 170
THR A 216
ARG A 220
LYS A 234
GLY A 236
THR A 237
MER  A 401 (-1.3A)
MER  A 401 (-2.8A)
MER  A 401 (-2.9A)
MER  A 401 ( 3.9A)
MER  A 401 ( 3.9A)
MER  A 401 (-3.0A)
MER  A 401 (-3.6A)
MER  A 401 (-3.7A)
0.42A 6b68D-4ev4A:
39.5
6b68D-4ev4A:
18.10
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.
4ewf BETA-LACTAMASE

(Sphaerobacter
thermophilus)
PF13354
(Beta-lactamase2)
6 SER A  49
SER A 110
ARG A 197
LYS A 213
GLY A 215
GLU A 250
SO4  A 301 (-3.1A)
SO4  A 301 (-3.1A)
SO4  A 301 ( 3.7A)
SO4  A 301 (-3.0A)
SO4  A 301 (-3.5A)
None
0.33A 6b68D-4ewfA:
30.8
6b68D-4ewfA:
15.45
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.
4fsf PENICILLIN-BINDING
PROTEIN 3


(Pseudomonas
aeruginosa)
PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
5 SER A 294
SER A 349
LYS A 484
GLY A 486
THR A 487
0W0  A 601 (-1.4A)
0W0  A 601 (-3.1A)
0W0  A 601 (-3.0A)
0W0  A 601 (-3.4A)
0W0  A 601 (-3.7A)
0.38A 6b68D-4fsfA:
17.0
6b68D-4fsfA:
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.
4gn2 OXACILLINASE

(Pseudomonas
aeruginosa)
PF00905
(Transpeptidase)
6 SER A  63
SER A 112
LYS A 208
GLY A 210
THR A 211
GLY A 212
KCX  A  66 ( 2.9A)
KCX  A  66 ( 3.5A)
KCX  A  66 ( 4.5A)
None
None
None
0.35A 6b68D-4gn2A:
17.3
6b68D-4gn2A:
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.
4ied CLASS D
BETA-LACTAMASE


(Fusobacterium
nucleatum)
PF00905
(Transpeptidase)
6 SER A  57
SER A 106
ARG A 239
LYS A 196
GLY A 198
ASP A 202
KCX  A  60 ( 2.7A)
KCX  A  60 ( 3.4A)
None
KCX  A  60 ( 4.5A)
None
None
1.12A 6b68D-4iedA:
19.2
6b68D-4iedA:
15.51
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4k0x BETA-LACTAMASE

(Acinetobacter
baumannii)
PF00905
(Transpeptidase)
6 SER A  79
SER A 126
ARG A 259
LYS A 216
GLY A 218
ASP A 222
KCX  A  82 (-2.5A)
BCT  A 301 (-2.8A)
BCT  A 301 (-3.0A)
BCT  A 301 (-3.0A)
BCT  A 301 (-3.4A)
None
0.89A 6b68D-4k0xA:
19.3
6b68D-4k0xA:
16.15
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.
4mnr PEPTIDOGLYCAN
GLYCOSYLTRANSFERASE


(Eggerthella
lenta)
PF00905
(Transpeptidase)
5 SER A 237
THR A 383
LYS A 397
GLY A 399
THR A 400
None
0.61A 6b68D-4mnrA:
16.7
6b68D-4mnrA:
13.93
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.
4oh0 BETA-LACTAMASE
OXA-58


(Acinetobacter
baumannii)
PF00905
(Transpeptidase)
5 SER A  83
SER A 130
LYS A 220
GLY A 222
GLY A 224
KCX  A  86 ( 2.6A)
KCX  A  86 ( 3.3A)
CL  A 301 ( 4.4A)
CL  A 301 (-3.6A)
None
0.58A 6b68D-4oh0A:
17.8
6b68D-4oh0A:
12.87
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.
4oon PENICILLIN-BINDING
PROTEIN 1A


(Pseudomonas
aeruginosa)
PF00905
(Transpeptidase)
PF00912
(Transgly)
PF17092
(PCB_OB)
6 SER A 461
SER A 520
THR A 680
LYS A 695
GLY A 697
THR A 698
2U4  A 901 (-1.3A)
2U4  A 901 (-3.6A)
2U4  A 901 (-4.1A)
2U4  A 901 ( 4.3A)
2U4  A 901 (-3.7A)
2U4  A 901 (-3.8A)
0.70A 6b68D-4oonA:
16.1
6b68D-4oonA:
7.94
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.
4ovd PEPTIDOGLYCAN
GLYCOSYLTRANSFERASE


(Atopobium
parvulum)
PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
6 SER A 361
THR A 486
LYS A 500
GLY A 502
THR A 503
GLY A 504
CA  A 601 ( 3.8A)
CA  A 601 ( 4.7A)
CA  A 601 ( 4.1A)
CA  A 601 ( 4.2A)
None
None
1.11A 6b68D-4ovdA:
17.0
6b68D-4ovdA:
9.37
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.
4ra7 PEPTIDOGLYCAN
GLYCOSYLTRANSFERASE


(Atopobium
parvulum)
PF00905
(Transpeptidase)
7 SER A 682
SER A 737
THR A 876
LYS A 890
GLY A 892
THR A 893
ASP A 895
NXU  A1001 (-1.3A)
NXU  A1001 (-3.2A)
NXU  A1001 (-4.0A)
NXU  A1001 (-3.5A)
NXU  A1001 (-3.4A)
NXU  A1001 (-3.9A)
NXU  A1001 (-3.1A)
0.58A 6b68D-4ra7A:
16.2
6b68D-4ra7A:
13.23
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.
4yfm BETA-LACTAMASE

(Mycobacteroides
abscessus)
PF13354
(Beta-lactamase2)
7 SER A  71
SER A 131
ASN A 171
THR A 215
LYS A 233
GLY A 235
GLY A 237
ACT  A 301 (-3.5A)
ACT  A 301 (-2.9A)
None
ACT  A 301 (-3.7A)
ACT  A 301 (-3.4A)
ACT  A 301 (-3.3A)
None
0.34A 6b68D-4yfmA:
39.7
6b68D-4yfmA:
17.83
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.
4ztk CELL DIVISION
PROTEIN
FTSI/PENICILLIN
BINDING PROTEIN 2


(Legionella
pneumophila)
PF00905
(Transpeptidase)
6 SER A 400
SER A 454
THR A 554
LYS A 568
GLY A 570
GLU A 617
NHE  A 901 (-3.2A)
NHE  A 901 (-2.9A)
NHE  A 901 ( 4.2A)
NHE  A 901 (-3.0A)
NHE  A 901 (-3.6A)
None
1.02A 6b68D-4ztkA:
16.1
6b68D-4ztkA:
11.74
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.
4ztk CELL DIVISION
PROTEIN
FTSI/PENICILLIN
BINDING PROTEIN 2


(Legionella
pneumophila)
PF00905
(Transpeptidase)
6 SER A 400
SER A 454
THR A 554
LYS A 568
GLY A 570
THR A 571
NHE  A 901 (-3.2A)
NHE  A 901 (-2.9A)
NHE  A 901 ( 4.2A)
NHE  A 901 (-3.0A)
NHE  A 901 (-3.6A)
NHE  A 901 (-3.8A)
0.49A 6b68D-4ztkA:
16.1
6b68D-4ztkA:
11.74
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.
5aqa OFF7_DB04V3

(synthetic
construct)
PF00023
(Ank)
PF12796
(Ank_2)
PF13354
(Beta-lactamase2)
6 SER A 200
SER A 260
ASN A 300
LYS A 364
GLY A 366
GLY A 368
None
0.42A 6b68D-5aqaA:
35.8
6b68D-5aqaA:
11.27
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.
5boh BETA-LACTAMASE

(Acinetobacter
baumannii)
PF00905
(Transpeptidase)
6 SER A  83
SER A 130
ARG A 263
LYS A 220
GLY A 222
GLY A 224
KCX  A  86 ( 2.7A)
KCX  A  86 ( 3.5A)
None
KCX  A  86 ( 4.5A)
None
None
0.90A 6b68D-5bohA:
18.3
6b68D-5bohA:
12.15
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.
5cer BD0816

(Bdellovibrio
bacteriovorus)
PF02113
(Peptidase_S13)
5 SER A 239
THR A 330
LYS A 345
GLY A 347
THR A 348
None
0.31A 6b68D-5cerA:
17.8
6b68D-5cerA:
11.61
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.
5ctm BETA-LACTAMASE

(Bacillus
pumilus)
PF00905
(Transpeptidase)
5 SER A 101
SER A 149
LYS A 239
GLY A 241
GLY A 243
KCX  A 104 (-2.2A)
FLC  A 301 (-2.5A)
FLC  A 301 (-3.0A)
FLC  A 301 (-3.2A)
None
0.61A 6b68D-5ctmA:
17.4
6b68D-5ctmA:
13.45
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.
5cxw PENICILLIN-BINDING
PROTEIN 1A


(Mycobacterium
tuberculosis)
PF00905
(Transpeptidase)
5 SER A 345
SER A 398
LYS A 539
GLY A 541
THR A 542
35P  A 702 (-1.3A)
35P  A 702 (-2.9A)
35P  A 702 (-3.3A)
35P  A 702 (-3.5A)
35P  A 702 (-3.7A)
0.38A 6b68D-5cxwA:
17.1
6b68D-5cxwA:
13.23
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.
5e2e BETA-LACTAMASE

(Yersinia
enterocolitica)
PF13354
(Beta-lactamase2)
8 SER A  47
SER A 107
ASN A 147
THR A 193
ARG A 251
GLY A 213
GLY A 215
ASP A 216
None
0.95A 6b68D-5e2eA:
41.2
6b68D-5e2eA:
14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e2e BETA-LACTAMASE

(Yersinia
enterocolitica)
PF13354
(Beta-lactamase2)
8 SER A  47
SER A 107
ASN A 147
THR A 193
LYS A 211
GLY A 213
GLY A 215
ASP A 216
None
0.48A 6b68D-5e2eA:
41.2
6b68D-5e2eA:
14.50
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5e2h BETA-LACTAMASE

(Mycolicibacterium
smegmatis)
PF00144
(Beta-lactamase)
5 SER A  58
ARG A 341
LYS A 307
GLY A 309
ASP A 312
None
0.66A 6b68D-5e2hA:
15.2
6b68D-5e2hA:
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.
5e43 BETA-LACTAMASE

(Streptosporangium
roseum)
PF13354
(Beta-lactamase2)
8 SER A  70
SER A 131
ASN A 171
THR A 217
ARG A 221
LYS A 235
GLY A 237
THR A 238
ACT  A 311 (-3.2A)
ACT  A 311 (-3.0A)
None
ACT  A 311 ( 3.9A)
ACT  A 311 (-4.5A)
ACT  A 311 (-3.3A)
ACT  A 311 (-3.2A)
ACT  A 311 (-3.8A)
0.35A 6b68D-5e43A:
41.1
6b68D-5e43A:
15.11
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.
5eoe BETA-LACTAMASE

(Pseudomonas
aeruginosa)
PF13354
(Beta-lactamase2)
6 SER A  62
SER A 123
ASN A 163
THR A 209
LYS A 227
GLY A 229
CIT  A 303 (-2.8A)
CIT  A 303 (-2.5A)
None
CIT  A 303 (-3.2A)
CIT  A 303 (-3.5A)
CIT  A 303 (-3.5A)
0.38A 6b68D-5eoeA:
39.4
6b68D-5eoeA:
16.08
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.
5f83 BETA-LACTAMASE

(Pseudomonas
aeruginosa)
PF13354
(Beta-lactamase2)
6 SER A  64
SER A 125
THR A 211
LYS A 229
GLY A 231
THR A 232
IM2  A 301 (-1.4A)
IM2  A 301 (-2.7A)
IM2  A 301 (-4.1A)
IM2  A 301 (-3.3A)
IM2  A 301 (-3.3A)
IM2  A 301 (-4.0A)
0.40A 6b68D-5f83A:
38.3
6b68D-5f83A:
15.99
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.
5gl9 BETA-LACTAMASE

(Burkholderia
thailandensis)
PF13354
(Beta-lactamase2)
10 SER A  70
SER A 130
ASN A 170
THR A 216
ARG A 220
LYS A 234
GLY A 236
THR A 237
GLY A 238
ASP A 240
None
0.37A 6b68D-5gl9A:
41.1
6b68D-5gl9A:
18.28
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.
5hlb PENICILLIN-BINDING
PROTEIN 1B


(Escherichia
coli)
PF00905
(Transpeptidase)
PF00912
(Transgly)
PF14814
(UB2H)
6 SER A 510
SER A 572
THR A 682
LYS A 698
GLY A 700
THR A 701
AZR  A 902 (-1.4A)
AZR  A 902 ( 3.7A)
AZR  A 902 (-3.4A)
AZR  A 902 ( 4.5A)
AZR  A 902 (-3.3A)
AZR  A 902 (-4.3A)
0.58A 6b68D-5hlbA:
17.6
6b68D-5hlbA:
8.41
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hw3 BETA-LACTAMASE

(Burkholderia
vietnamiensis)
PF13354
(Beta-lactamase2)
6 SER A  70
ASN A 171
ARG A 219
GLY A 235
THR A 236
GLU A 273
SO4  A 301 (-2.7A)
ACT  A 310 (-4.0A)
SO4  A 301 ( 4.2A)
SO4  A 301 (-3.4A)
SO4  A 301 (-3.5A)
None
0.27A 6b68D-5hw3A:
38.4
6b68D-5hw3A:
40.70
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5hw3 BETA-LACTAMASE

(Burkholderia
vietnamiensis)
PF13354
(Beta-lactamase2)
6 SER A  70
SER A 131
ARG A 219
GLY A 235
THR A 236
GLU A 273
SO4  A 301 (-2.7A)
SO4  A 301 (-2.6A)
SO4  A 301 ( 4.2A)
SO4  A 301 (-3.4A)
SO4  A 301 (-3.5A)
None
0.49A 6b68D-5hw3A:
38.4
6b68D-5hw3A:
40.70
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.
5hx9 BETA-LACTAMASE

(Burkholderia
vietnamiensis)
PF13354
(Beta-lactamase2)
5 ASN A 170
LYS A 234
GLY A 236
THR A 237
GLY A 238
None
EDO  A 303 (-2.6A)
None
None
None
0.47A 6b68D-5hx9A:
38.7
6b68D-5hx9A:
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.
5ihv BETA-LACTAMASE

(Burkholderia
ambifaria)
PF13354
(Beta-lactamase2)
5 ASN A 147
LYS A 211
GLY A 213
THR A 214
GLY A 215
None
EDO  A 302 (-2.8A)
None
None
None
0.48A 6b68D-5ihvA:
39.0
6b68D-5ihvA:
21.74
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.
5iy2 BETA-LACTAMASE
OXA-143


(Acinetobacter
baumannii)
PF00905
(Transpeptidase)
6 SER A  81
SER A 128
ARG A 261
LYS A 218
GLY A 220
ASP A 224
KCX  A  84 (-2.7A)
GOL  A 301 (-3.6A)
GOL  A 301 (-3.1A)
GOL  A 301 ( 4.7A)
GOL  A 301 (-3.3A)
None
1.11A 6b68D-5iy2A:
19.4
6b68D-5iy2A:
17.70
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.
5iy2 BETA-LACTAMASE
OXA-143


(Acinetobacter
baumannii)
PF00905
(Transpeptidase)
6 SER A  81
SER A 128
ARG A 261
LYS A 218
GLY A 220
GLY A 222
KCX  A  84 (-2.7A)
GOL  A 301 (-3.6A)
GOL  A 301 (-3.1A)
GOL  A 301 ( 4.7A)
GOL  A 301 (-3.3A)
None
0.97A 6b68D-5iy2A:
19.4
6b68D-5iy2A:
17.70
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.
5kzh BETA-LACTAMASE

(Acinetobacter
baumannii)
PF00905
(Transpeptidase)
6 SER A  80
SER A 127
ARG A 260
LYS A 217
GLY A 219
ASP A 223
FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
0.98A 6b68D-5kzhA:
19.6
6b68D-5kzhA:
17.22
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.
5kzh BETA-LACTAMASE

(Acinetobacter
baumannii)
PF00905
(Transpeptidase)
6 SER A  80
SER A 127
ARG A 260
LYS A 217
GLY A 219
GLY A 221
FMT  A 301 (-2.5A)
FMT  A 301 (-3.3A)
None
KCX  A  83 ( 4.9A)
FMT  A 301 (-3.3A)
None
0.86A 6b68D-5kzhA:
19.6
6b68D-5kzhA:
17.22
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
5ll7 BETA-LACTAMASE

(Escherichia
coli)
no annotation 9 SER A  70
SER A 130
ASN A 170
THR A 216
ARG A 220
LYS A 234
GLY A 236
THR A 237
GLU A 276
6YV  A 301 (-1.7A)
6YV  A 301 (-2.6A)
6YV  A 301 (-2.9A)
6YV  A 301 ( 4.2A)
6YV  A 301 ( 3.7A)
6YV  A 301 (-3.6A)
6YV  A 301 ( 4.0A)
6YV  A 301 (-3.6A)
None
0.38A 6b68D-5ll7A:
40.2
6b68D-5ll7A:
40.00
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.
5lp4 PENICILLIN-BINDING
PROTEIN 2 (PBP2)


(Helicobacter
pylori)
PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
5 SER A 311
SER A 366
THR A 498
LYS A 513
GLY A 515
None
0.63A 6b68D-5lp4A:
15.9
6b68D-5lp4A:
9.67
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.
5tfq BETA-LACTAMASE

(Bacteroides
cellulosilyticus)
PF13354
(Beta-lactamase2)
6 SER A  48
SER A 112
THR A 197
LYS A 215
GLY A 217
ASP A 220
PO4  A 301 (-3.8A)
PO4  A 301 (-2.6A)
PO4  A 301 ( 3.8A)
PO4  A 301 (-3.2A)
PO4  A 301 (-3.3A)
None
0.56A 6b68D-5tfqA:
31.3
6b68D-5tfqA:
11.76
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.
5tr7 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE


(Vibrio cholerae)
PF00768
(Peptidase_S11)
PF07943
(PBP5_C)
6 SER A  66
SER A 129
ARG A 267
LYS A 232
GLY A 234
GLU A 264
None
None
NO2  A 403 (-3.7A)
None
None
NO2  A 403 (-4.2A)
0.83A 6b68D-5tr7A:
21.9
6b68D-5tr7A:
13.71
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.
5tro PENICILLIN-BINDING
PROTEIN 1


(Staphylococcus
aureus)
PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
5 SER A 314
SER A 368
LYS A 513
GLY A 515
THR A 516
None
0.36A 6b68D-5troA:
17.0
6b68D-5troA:
10.38
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.
5ty7 PENICILLIN-BINDING
PROTEIN 4


(Staphylococcus
aureus)
no annotation 6 SER A  75
SER A 139
LYS A 259
GLY A 261
ASP A 264
GLU A 297
NFF  A 401 (-1.1A)
NFF  A 401 (-3.4A)
NFF  A 401 ( 4.8A)
NFF  A 401 (-3.7A)
NFF  A 401 ( 4.3A)
None
0.69A 6b68D-5ty7A:
20.7
6b68D-5ty7A:
19.32
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5u2g PENICILLIN-BINDING
PROTEIN 1A


(Haemophilus
influenzae)
PF00905
(Transpeptidase)
PF00912
(Transgly)
PF17092
(PCB_OB)
5 SER A 510
THR A 712
LYS A 728
GLY A 730
THR A 731
None
None
None
None
CL  A 910 (-4.2A)
0.68A 6b68D-5u2gA:
16.6
6b68D-5u2gA:
6.99
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.
5u47 PENICILLIN BINDING
PROTEIN 2X


(Streptococcus
thermophilus)
PF00905
(Transpeptidase)
PF03717
(PBP_dimer)
PF03793
(PASTA)
6 SER A 343
SER A 402
THR A 532
LYS A 553
GLY A 555
THR A 556
None
0.62A 6b68D-5u47A:
16.4
6b68D-5u47A:
11.75
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.
5vfd BETA-LACTAMASE

(Acinetobacter
baumannii)
PF00905
(Transpeptidase)
6 SER A  81
SER A 128
ARG A 261
LYS A 218
GLY A 220
GLY A 222
9CP  A 306 (-1.4A)
9CP  A 306 (-2.8A)
9CP  A 306 (-2.7A)
9CP  A 306 (-3.0A)
9CP  A 306 (-3.5A)
9CP  A 306 ( 4.4A)
0.89A 6b68D-5vfdA:
18.9
6b68D-5vfdA:
17.22
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.
5vpq BETA-LACTAMASE

(Paraburkholderia
phymatum)
PF13354
(Beta-lactamase2)
8 SER A  58
SER A 119
ASN A 159
THR A 206
ARG A 210
GLY A 227
GLY A 229
ASP A 230
None
None
None
None
None
None
EDO  A 304 (-3.4A)
EDO  A 304 (-3.7A)
0.64A 6b68D-5vpqA:
39.5
6b68D-5vpqA:
16.34
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.
5x5g BETA-LACTAMASE

(Serratia
marcescens)
PF13354
(Beta-lactamase2)
8 SER A  56
SER A 120
THR A 206
ARG A 210
LYS A 224
GLY A 226
ASP A 229
GLU A 270
OP0  A 305 (-1.5A)
OP0  A 305 (-2.7A)
OP0  A 305 (-3.6A)
OP0  A 305 (-3.6A)
OP0  A 305 (-3.4A)
OP0  A 305 (-3.2A)
OP0  A 305 (-3.6A)
SO4  A 302 (-3.0A)
0.64A 6b68D-5x5gA:
32.6
6b68D-5x5gA:
15.56
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.
5zqe -

(-)
no annotation 7 SER A  58
SER A 118
THR A 208
ARG A 257
LYS A 222
GLY A 224
ASP A 227
CES  A 301 (-1.3A)
CES  A 301 ( 3.7A)
CES  A 301 (-4.3A)
CES  A 301 (-2.9A)
None
CES  A 301 (-3.2A)
None
0.81A 6b68D-5zqeA:
21.6
6b68D-5zqeA:
undetectable
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6bu3 BETA-LACTAMASE

(Escherichia
coli)
no annotation 7 SER A  70
SER A 130
ASN A 170
THR A 216
LYS A 234
GLY A 236
GLY A 238
3GK  A 301 ( 3.8A)
3GK  A 301 (-2.7A)
3GK  A 301 (-3.9A)
3GK  A 302 ( 4.3A)
3GK  A 301 ( 4.1A)
3GK  A 301 (-3.4A)
3GK  A 301 (-3.6A)
0.47A 6b68D-6bu3A:
41.4
6b68D-6bu3A:
33.75