SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3v39'

List of Similar Pattern of Amino Acids

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 on the DrReposER ID to view details on interfaces and similar patterns of amino acids)
(Click on the view link on the last column to view superposed patterns of amino acids)
Filter list by:
DrReposER ID / Desc. Hit
PDBID
Hit
Macromolecule
Res.
Matches
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.
1ERR_B_CCSB381_0
(ESTROGEN RECEPTOR)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
3 / 3 GLU A 377
ALA A  48
SER A  51
None
0.65A 1errB-3v39A:
undetectable
1errB-3v39A:
21.13
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.
1GHM_A_CEDA1_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
7 / 12 ALA A  69
SER A  70
LYS A  73
SER A 251
ASN A 253
LYS A 357
GLY A 359
TAU  A 501 (-3.4A)
TAU  A 501 (-1.5A)
TAU  A 501 ( 3.7A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.30A 1ghmA-3v39A:
17.7
1ghmA-3v39A:
23.00
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I2W_A_CFXA1300_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
8 / 12 ALA A  69
SER A  70
LYS A  73
SER A 251
ASN A 253
THR A 342
LYS A 357
GLY A 359
TAU  A 501 (-3.4A)
TAU  A 501 (-1.5A)
TAU  A 501 ( 3.7A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
None
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.35A 1i2wA-3v39A:
17.9
1i2wA-3v39A:
22.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1I2W_B_CFXB2300_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
7 / 12 ALA A  69
SER A  70
LYS A  73
SER A 251
ASN A 253
THR A 342
GLY A 359
TAU  A 501 (-3.4A)
TAU  A 501 (-1.5A)
TAU  A 501 ( 3.7A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
None
TAU  A 501 (-3.5A)
0.34A 1i2wB-3v39A:
18.0
1i2wB-3v39A:
22.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JR1_B_MOAB1333_1
(INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE 2)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
4 / 8 SER A 251
ASN A 252
GLY A 158
GLY A 291
TAU  A 501 (-2.6A)
None
TAU  A 501 ( 4.3A)
None
0.86A 1jr1B-3v39A:
undetectable
1jr1B-3v39A:
22.24
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1M4I_A_KANA500_1
(AMINOGLYCOSIDE
2'-N-ACETYLTRANSFERA
SE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
4 / 8 GLY A 352
SER A 370
ASP A 318
ASP A 327
None
0.74A 1m4iA-3v39A:
undetectable
1m4iA-3v39A:
16.99
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.
1MEH_A_MOAA600_1
(INOSINE-5'-MONOPHOSP
HATE DEHYDROGENASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 10 SER A 251
ASN A 252
ILE A 157
GLY A 158
GLY A 291
TAU  A 501 (-2.6A)
None
None
TAU  A 501 ( 4.3A)
None
1.18A 1mehA-3v39A:
undetectable
1mehA-3v39A:
22.65
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.
1N4F_A_ASRA141_0
(LYSOZYME C)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
4 / 6 ASN A 292
GLY A 159
THR A 161
PRO A 162
TAU  A 501 (-3.7A)
None
None
None
0.85A 1n4fA-3v39A:
undetectable
1n4fA-3v39A:
15.61
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.
1YMX_A_CFXA1001_1
(BETA-LACTAMASE
CTX-M-9)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
7 / 12 SER A  70
LYS A  73
SER A 251
ASN A 253
THR A 342
LYS A 357
GLY A 359
TAU  A 501 (-1.5A)
TAU  A 501 ( 3.7A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
None
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.29A 1ymxA-3v39A:
17.5
1ymxA-3v39A:
20.72
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.
1YMX_B_CFXB1002_1
(BETA-LACTAMASE
CTX-M-9)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A  70
LYS A  73
SER A 251
ASN A 253
LYS A 357
GLY A 359
TAU  A 501 (-1.5A)
TAU  A 501 ( 3.7A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.27A 1ymxB-3v39A:
17.4
1ymxB-3v39A:
20.72
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.
2WEY_B_EV1B1771_1
(CAMP AND
CAMP-INHIBITED CGMP
3', 5'-CYCLIC
PHOSPHODIESTERASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
4 / 8 LEU A  68
ILE A 273
TYR A 272
PHE A 269
None
0.97A 2weyB-3v39A:
undetectable
2weyB-3v39A:
19.73
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.
2XZ5_D_ACHD1211_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
4 / 8 GLN A 401
ASP A 394
TYR A  40
SER A 391
None
1.17A 2xz5C-3v39A:
undetectable
2xz5D-3v39A:
undetectable
2xz5C-3v39A:
18.69
2xz5D-3v39A:
18.69
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.
3FPJ_B_SAMB301_1
(PUTATIVE
UNCHARACTERIZED
PROTEIN)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
4 / 7 GLY A 289
GLY A 291
THR A 161
ALA A 256
None
0.71A 3fpjB-3v39A:
undetectable
3fpjB-3v39A:
22.09
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HLW_A_CE3A301_1
(CTX-M-9
EXTENDED-SPECTRUM
BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 LYS A  73
SER A 251
ASN A 253
THR A 342
LYS A 357
GLY A 359
TAU  A 501 ( 3.7A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
None
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.37A 3hlwA-3v39A:
17.5
3hlwA-3v39A:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HLW_B_CE3B302_1
(CTX-M-9
EXTENDED-SPECTRUM
BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A 251
ASN A 253
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.28A 3hlwB-3v39A:
17.5
3hlwB-3v39A:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3HUO_A_PNNA300_0
(CTX-M-9
EXTENDED-SPECTRUM
BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 12 LYS A  73
ASN A 253
LYS A 357
THR A 358
GLY A 359
TAU  A 501 ( 3.7A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.33A 3huoA-3v39A:
17.5
3huoA-3v39A:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MZE_A_CFXA364_1
(D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE
DACA)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 ALA A  69
SER A  70
LYS A  73
ASN A 253
THR A 358
GLY A 359
TAU  A 501 (-3.4A)
TAU  A 501 (-1.5A)
TAU  A 501 ( 3.7A)
TAU  A 501 (-3.1A)
None
TAU  A 501 (-3.5A)
0.36A 3mzeA-3v39A:
7.8
3mzeA-3v39A:
22.80
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3NY4_A_SMXA308_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A  70
ILE A 157
SER A 251
THR A 342
LYS A 357
THR A 358
TAU  A 501 (-1.5A)
None
TAU  A 501 (-2.6A)
None
TAU  A 501 ( 4.3A)
None
1.25A 3ny4A-3v39A:
16.5
3ny4A-3v39A:
22.42
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.
3NY4_A_SMXA308_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A  70
SER A 251
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.50A 3ny4A-3v39A:
16.5
3ny4A-3v39A:
22.42
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.
3Q07_A_WPPA300_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 LYS A  73
SER A 251
ASN A 253
LYS A 357
GLY A 359
SER A 360
TAU  A 501 ( 3.7A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
None
0.50A 3q07A-3v39A:
17.4
3q07A-3v39A:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3Q07_B_WPPB400_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 12 LYS A  73
SER A 251
ASN A 253
LYS A 357
GLY A 359
TAU  A 501 ( 3.7A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.33A 3q07B-3v39A:
17.7
3q07B-3v39A:
20.96
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SFU_C_RBVC601_1
(RNA POLYMERASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 11 ARG A 246
LEU A 115
THR A 161
ASN A 253
GLY A 158
PGE  A 505 (-3.2A)
None
None
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
1.12A 3sfuC-3v39A:
undetectable
3sfuC-3v39A:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SH8_A_CEDA1_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
7 / 12 ALA A  69
SER A  70
SER A 251
ASN A 253
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-3.4A)
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.33A 3sh8A-3v39A:
17.9
3sh8A-3v39A:
22.67
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.
3SH8_B_CEDB1_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
7 / 12 ALA A  69
SER A  70
LYS A  73
SER A 251
ASN A 253
LYS A 357
GLY A 359
TAU  A 501 (-3.4A)
TAU  A 501 (-1.5A)
TAU  A 501 ( 3.7A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.45A 3sh8B-3v39A:
18.0
3sh8B-3v39A:
22.67
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.
3TTR_A_LQZA90_1
(LACTOTRANSFERRIN)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
3 / 3 PRO A 416
THR A 373
LEU A 409
None
0.80A 3ttrA-3v39A:
undetectable
3ttrA-3v39A:
21.02
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.
3V5W_A_8PRA701_2
(G-PROTEIN COUPLED
RECEPTOR KINASE 2)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
3 / 3 LEU A  78
MET A 310
ASP A 283
None
0.73A 3v5wA-3v39A:
undetectable
3v5wA-3v39A:
21.02
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.
3V5W_A_8PRA701_2
(G-PROTEIN COUPLED
RECEPTOR KINASE 2)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
3 / 3 LEU A 244
MET A 332
ASP A 327
None
0.92A 3v5wA-3v39A:
undetectable
3v5wA-3v39A:
21.02
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.
3VWR_A_ACAA601_1
(6-AMINOHEXANOATE-DIM
ER HYDROLASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 11 ALA A  69
PHE A 286
ASN A 303
GLY A 359
ILE A  71
TAU  A 501 (-3.4A)
None
None
TAU  A 501 (-3.5A)
None
1.44A 3vwrA-3v39A:
12.5
3vwrA-3v39A:
19.47
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3W1W_A_CHDA1504_0
(FERROCHELATASE,
MITOCHONDRIAL)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
4 / 4 PRO A 428
LEU A 427
ILE A 201
ARG A 200
None
1.46A 3w1wA-3v39A:
undetectable
3w1wA-3v39A:
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.
4EUZ_A_MEMA401_1
(CARBAPENEM-HYDROLIZI
NG BETA-LACTAMASE
SFC-1)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
7 / 12 LYS A  73
SER A 251
ASN A 253
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 ( 3.7A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.37A 4euzA-3v39A:
16.8
4euzA-3v39A:
22.65
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.
4FH2_A_0RNA303_1
(BETA-LACTAMASE SHV-1)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 10 SER A 251
ASN A 253
LYS A 357
THR A 358
GLY A 359
ALA A  69
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
TAU  A 501 (-3.4A)
1.42A 4fh2A-3v39A:
18.5
4fh2A-3v39A:
19.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MA3_L_ACTL301_0
(C2095 HEAVY CHAIN
C2095 LIGHT CHAIN)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
3 / 3 PRO A  67
ASN A  42
HIS A 385
None
1.00A 4ma3H-3v39A:
undetectable
4ma3L-3v39A:
undetectable
4ma3H-3v39A:
21.81
4ma3L-3v39A:
19.71
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.
4N9K_A_CEDA301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
7 / 12 ALA A  69
SER A  70
SER A 251
ASN A 253
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-3.4A)
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.32A 4n9kA-3v39A:
18.1
4n9kA-3v39A:
22.67
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.
4N9K_B_CEDB301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
7 / 12 ALA A  69
SER A  70
SER A 251
ASN A 253
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-3.4A)
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.35A 4n9kB-3v39A:
18.1
4n9kB-3v39A:
22.67
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.
4PM5_A_CE3A301_1
(BETA-LACTAMASE
CTX-M-14)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 12 ASN A 253
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-3.1A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.31A 4pm5A-3v39A:
17.7
4pm5A-3v39A:
20.72
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.
4PM7_A_CE3A301_1
(BETA-LACTAMASE
CTX-M-14)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 12 LYS A  73
ASN A 253
THR A 342
LYS A 357
GLY A 359
TAU  A 501 ( 3.7A)
TAU  A 501 (-3.1A)
None
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.42A 4pm7A-3v39A:
17.8
4pm7A-3v39A:
22.28
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.
4PM7_A_CE3A301_1
(BETA-LACTAMASE
CTX-M-14)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 12 LYS A  73
SER A 251
ASN A 253
LYS A 357
GLY A 359
TAU  A 501 ( 3.7A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.72A 4pm7A-3v39A:
17.8
4pm7A-3v39A:
22.28
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.
4PM9_A_CE3A301_1
(BETA-LACTAMASE
CTX-M-14)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 12 ASN A 253
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-3.1A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.34A 4pm9A-3v39A:
17.6
4pm9A-3v39A:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PM9_A_CE3A301_1
(BETA-LACTAMASE
CTX-M-14)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A 251
ASN A 253
LYS A 357
THR A 358
GLY A 359
ALA A  69
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
TAU  A 501 (-3.4A)
1.47A 4pm9A-3v39A:
17.6
4pm9A-3v39A:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4UIN_H_QI9H1226_0
(FAB 314.3)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 12 HIS A  95
THR A 232
GLU A 109
GLY A 110
PHE A 224
SO4  A 502 (-4.6A)
SO4  A 502 (-3.3A)
None
None
None
1.48A 4uinH-3v39A:
undetectable
4uinL-3v39A:
undetectable
4uinH-3v39A:
19.62
4uinL-3v39A:
18.82
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.
5DQF_A_CZEA613_1
(SERUM ALBUMIN)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 9 ARG A  83
ALA A  80
GLY A  85
LEU A 240
LEU A 259
None
1.16A 5dqfA-3v39A:
undetectable
5dqfA-3v39A:
22.05
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5GHY_A_CEDA301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 ALA A  69
SER A  70
SER A 251
ASN A 253
LYS A 357
GLY A 359
TAU  A 501 (-3.4A)
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.34A 5ghyA-3v39A:
17.9
5ghyA-3v39A:
22.67
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.
5GHY_B_CEDB301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 ALA A  69
SER A  70
SER A 251
ASN A 253
LYS A 357
GLY A 359
TAU  A 501 (-3.4A)
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.33A 5ghyB-3v39A:
17.9
5ghyB-3v39A:
22.67
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.
5GHZ_A_CEDA301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
7 / 11 ALA A  69
SER A  70
SER A 251
ASN A 253
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-3.4A)
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.34A 5ghzA-3v39A:
18.0
5ghzA-3v39A:
22.67
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.
5GHZ_B_CEDB301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
7 / 10 ALA A  69
SER A  70
SER A 251
ASN A 253
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-3.4A)
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.32A 5ghzB-3v39A:
18.1
5ghzB-3v39A:
22.67
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.
5I9Y_A_1N1A1001_2
(EPHRIN TYPE-A
RECEPTOR 2)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
3 / 3 ILE A  71
ILE A 402
MET A 310
None
0.71A 5i9yA-3v39A:
undetectable
5i9yA-3v39A:
20.14
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6B5Y_B_9F2B400_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A  70
SER A 251
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.40A 6b5yB-3v39A:
17.0
6b5yB-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.
6B5Y_D_9F2D400_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A  70
SER A 251
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.45A 6b5yD-3v39A:
17.0
6b5yD-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.
6B68_B_9F2B301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A  70
SER A 251
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.25A 6b68B-3v39A:
17.0
6b68B-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.
6B68_D_9F2D400_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 12 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.
6B69_B_9F2B301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A  70
SER A 251
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.29A 6b69A-3v39A:
17.0
6b69B-3v39A:
16.8
6b69A-3v39A:
11.89
6b69B-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.
6B69_D_9F2D301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A  70
SER A 251
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.29A 6b69D-3v39A:
16.8
6b69D-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.
6B6A_B_9F2B301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A  70
SER A 251
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.29A 6b6aB-3v39A:
16.9
6b6aB-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.
6B6A_D_9F2D301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A  70
ILE A 157
SER A 251
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-1.5A)
None
TAU  A 501 (-2.6A)
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
1.10A 6b6aD-3v39A:
16.9
6b6aD-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.
6B6C_A_9F2A301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 12 SER A  70
SER A 251
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.33A 6b6cA-3v39A:
16.9
6b6cA-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.
6B6D_A_9F2A302_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A  70
SER A 251
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-1.5A)
TAU  A 501 (-2.6A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
0.65A 6b6dA-3v39A:
16.8
6b6dA-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.
6B6E_A_9F2A302_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
7 / 12 SER A  70
ILE A 157
SER A 251
THR A 342
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-1.5A)
None
TAU  A 501 (-2.6A)
None
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
1.28A 6b6eA-3v39A:
16.8
6b6eA-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.
6B6F_A_9F2A301_1
(BETA-LACTAMASE)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
6 / 12 SER A  70
ILE A 157
SER A 251
LYS A 357
THR A 358
GLY A 359
TAU  A 501 (-1.5A)
None
TAU  A 501 (-2.6A)
TAU  A 501 ( 4.3A)
None
TAU  A 501 (-3.5A)
1.26A 6b6fA-3v39A:
16.7
6b6fA-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.
6C79_A_CE3A301_1
(BETA-LACTAMASE
TOHO-1)
3v39 D-ALANYL-D-ALANINE
CARBOXYPEPTIDASE

(Bdellovibrio
bacteriovorus)
5 / 12 SER A 251
ASN A 253
THR A 342
LYS A 357
GLY A 359
TAU  A 501 (-2.6A)
TAU  A 501 (-3.1A)
None
TAU  A 501 ( 4.3A)
TAU  A 501 (-3.5A)
0.27A 6c79A-3v39A:
17.5
6c79A-3v39A:
12.89