SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2qf7'

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.
1AV2_C_DVAC6_0
(GRAMICIDIN A)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
3 / 3 ALA A 869
VAL A 864
TRP A 861
None
0.84A 1av2C-2qf7A:
undetectable
1av2D-2qf7A:
undetectable
1av2C-2qf7A:
2.25
1av2D-2qf7A:
2.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1CEA_A_ACAA90_1
(PLASMINOGEN)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 8 ASP A 563
ARG A 558
TYR A 821
THR A1009
None
1.48A 1ceaA-2qf7A:
undetectable
1ceaB-2qf7A:
undetectable
1ceaA-2qf7A:
5.56
1ceaB-2qf7A:
5.56
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.
1DHF_A_FOLA187_0
(DIHYDROFOLATE
REDUCTASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ILE A 381
ALA A 376
GLN A 351
ILE A 442
LEU A 350
None
1.04A 1dhfA-2qf7A:
undetectable
1dhfA-2qf7A:
10.71
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.
1DHF_B_FOLB187_0
(DIHYDROFOLATE
REDUCTASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ILE A 381
ALA A 376
GLN A 351
ILE A 442
LEU A 350
None
1.07A 1dhfB-2qf7A:
undetectable
1dhfB-2qf7A:
10.71
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.
1DLS_A_MTXA188_1
(DIHYDROFOLATE
REDUCTASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ILE A 381
ALA A 376
GLN A 351
ILE A 442
LEU A 350
None
1.11A 1dlsA-2qf7A:
undetectable
1dlsA-2qf7A:
10.71
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.
1DRF_A_FOLA187_0
(DIHYDROFOLATE
REDUCTASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ILE A 381
ALA A 376
GLN A 351
ILE A 442
LEU A 350
None
1.07A 1drfA-2qf7A:
undetectable
1drfA-2qf7A:
10.71
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.
1FFY_A_MRCA1993_1
(ISOLEUCYL-TRNA
SYNTHETASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 GLY A 622
ASN A 662
SER A 920
PHE A 654
VAL A 653
None
None
None
KCX  A 718 ( 4.2A)
None
1.02A 1ffyA-2qf7A:
undetectable
1ffyA-2qf7A:
22.52
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.
1ISM_B_NCAB305_0
(BONE MARROW STROMAL
CELL ANTIGEN 1)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 7 HIS A 749
LEU A 554
SER A 553
ASP A 549
ZN  A1157 (-3.3A)
None
None
ZN  A1157 (-2.6A)
1.18A 1ismB-2qf7A:
undetectable
1ismB-2qf7A:
13.81
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.
1LIN_A_TFPA155_1
(CALMODULIN)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 7 GLU A 248
PHE A 426
MET A 419
ALA A 415
None
1.33A 1linA-2qf7A:
undetectable
1linA-2qf7A:
9.97
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.
1W5U_C_DVAC6_0
(GRAMICIDIN D)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
3 / 3 ALA A 869
VAL A 864
TRP A 861
None
0.87A 1w5uC-2qf7A:
undetectable
1w5uD-2qf7A:
undetectable
1w5uC-2qf7A:
2.25
1w5uD-2qf7A:
2.25
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2A3C_A_PNXA1435_1
(CHITINASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 6 TYR A 987
GLY A 622
SER A 666
ARG A 621
None
1.29A 2a3cA-2qf7A:
8.3
2a3cA-2qf7A:
17.32
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.
2A3C_B_PNXB2434_1
(CHITINASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 6 TYR A 987
GLY A 622
SER A 666
ARG A 621
None
1.27A 2a3cB-2qf7A:
7.5
2a3cB-2qf7A:
17.32
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.
2ADM_A_SAMA500_0
(ADENINE-N6-DNA-METHY
LTRANSFERASE TAQI)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 11 THR A 588
ALA A 643
PRO A 600
ALA A 982
PHE A 651
None
0.97A 2admA-2qf7A:
undetectable
2admA-2qf7A:
17.65
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.
2ADM_B_SAMB500_0
(ADENINE-N6-DNA-METHY
LTRANSFERASE TAQI)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 11 THR A 588
ALA A 643
PRO A 600
ALA A 982
PHE A 651
None
0.98A 2admB-2qf7A:
2.8
2admB-2qf7A:
17.65
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.
2B60_B_RITB100_1
(GAG-POL POLYPROTEIN)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ALA A  85
ASP A  84
ILE A 322
ILE A  27
ILE A 111
None
0.84A 2b60A-2qf7A:
undetectable
2b60A-2qf7A:
9.04
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.
2BM9_B_SAMB301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 LEU A 575
GLU A 791
GLY A 787
SER A 794
ALA A 776
None
1.30A 2bm9B-2qf7A:
4.2
2bm9B-2qf7A:
12.32
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.
2DDW_A_PXLA1003_1
(PYRIDOXINE KINASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 8 SER A 238
VAL A 217
PRO A 253
TYR A 452
None
0.86A 2ddwA-2qf7A:
undetectable
2ddwA-2qf7A:
14.43
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2HS1_A_017A201_1
(HIV-1 PROTEASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ALA A  85
ASP A  84
ILE A 322
ILE A  27
ILE A 111
None
0.73A 2hs1A-2qf7A:
undetectable
2hs1A-2qf7A:
8.07
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2VAV_F_CSCF1383_2
(ACETYL-COA--DEACETYL
CEPHALOSPORIN C
ACETYLTRANSFERASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
3 / 3 LEU A 620
MET A 618
MET A 720
None
None
KCX  A 718 ( 3.6A)
0.88A 2vavF-2qf7A:
undetectable
2vavF-2qf7A:
17.77
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2W3M_A_FOLA1188_0
(DIHYDROFOLATE
REDUCTASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ILE A 381
ALA A 376
GLN A 351
ILE A 442
LEU A 350
None
1.12A 2w3mA-2qf7A:
undetectable
2w3mA-2qf7A:
10.23
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.
2WEK_A_DIFA1376_1
(ZINC-BINDING ALCOHOL
DEHYDROGENASE
DOMAIN-CONTAINING
PROTEIN 2)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 8 TYR A 700
LEU A 697
LEU A 732
ALA A 728
None
0.94A 2wekA-2qf7A:
4.5
2wekA-2qf7A:
16.62
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XZ5_B_ACHB1210_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 7 TYR A 631
VAL A 626
TYR A 628
TYR A 987
None
1.34A 2xz5B-2qf7A:
undetectable
2xz5E-2qf7A:
undetectable
2xz5B-2qf7A:
10.06
2xz5E-2qf7A:
10.06
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.
2XZ5_E_ACHE1210_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 7 TYR A 631
VAL A 626
TYR A 628
TYR A 987
None
1.34A 2xz5D-2qf7A:
undetectable
2xz5E-2qf7A:
undetectable
2xz5D-2qf7A:
10.06
2xz5E-2qf7A:
10.06
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.
3BJW_B_SVRB501_2
(PHOSPHOLIPASE A2)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 11 VAL A 230
LEU A 222
GLY A 223
ILE A 277
LYS A   1
None
1.10A 3bjwB-2qf7A:
undetectable
3bjwB-2qf7A:
7.50
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.
3BJW_E_SVRE503_1
(PHOSPHOLIPASE A2)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 11 VAL A 230
LEU A 222
GLY A 223
ILE A 277
LYS A   1
None
1.15A 3bjwE-2qf7A:
undetectable
3bjwE-2qf7A:
7.50
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.
3BJW_F_SVRF502_3
(PHOSPHOLIPASE A2)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 VAL A 230
LEU A 222
GLY A 223
ILE A 277
LYS A   1
None
1.11A 3bjwF-2qf7A:
undetectable
3bjwF-2qf7A:
7.50
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.
3BJW_G_SVRG506_3
(PHOSPHOLIPASE A2)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
3 / 3 PRO A 883
PHE A 875
LYS A 880
None
1.28A 3bjwG-2qf7A:
undetectable
3bjwG-2qf7A:
7.50
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.
3BRF_A_SORA1_0
(LIN-12 AND GLP-1
PHENOTYPE PROTEIN 1,
ISOFORM A)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
3 / 3 GLY A 801
ASP A 799
SER A 794
None
0.61A 3brfA-2qf7A:
undetectable
3brfA-2qf7A:
17.78
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3IB1_A_IMNA701_1
(LACTOTRANSFERRIN)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 4 PRO A 831
THR A 751
GLY A 550
THR A 546
None
0.99A 3ib1A-2qf7A:
2.0
3ib1A-2qf7A:
14.68
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.
3K9F_F_LFXF0_1
(DNA TOPOISOMERASE 4
SUBUNIT A
DNA TOPOISOMERASE 4
SUBUNIT B)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 5 SER A 826
ARG A 548
GLY A 550
GLU A 582
None
KCX  A 718 ( 3.6A)
None
None
1.34A 3k9fA-2qf7A:
undetectable
3k9fB-2qf7A:
undetectable
3k9fC-2qf7A:
undetectable
3k9fA-2qf7A:
18.66
3k9fB-2qf7A:
18.66
3k9fC-2qf7A:
13.84
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3UVV_A_T3A501_1
(THYROID HORMONE
RECEPTOR ALPHA)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ALA A1024
LEU A1007
LEU A 480
LEU A1016
ILE A1034
None
1.07A 3uvvA-2qf7A:
undetectable
3uvvA-2qf7A:
12.56
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.
4A97_I_ZPCI1318_2
(CYS-LOOP
LIGAND-GATED ION
CHANNEL)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 6 ILE A 270
TYR A 284
HIS A 216
VAL A 211
None
None
AGS  A1162 (-3.9A)
AGS  A1162 ( 4.6A)
1.23A 4a97I-2qf7A:
undetectable
4a97I-2qf7A:
13.82
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.
4BQT_C_C5EC301_0
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 8 TYR A 631
VAL A 626
TYR A 628
TYR A 987
None
1.26A 4bqtC-2qf7A:
undetectable
4bqtD-2qf7A:
undetectable
4bqtC-2qf7A:
10.24
4bqtD-2qf7A:
10.24
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.
4EYS_A_ACTA402_0
(MCCC FAMILY PROTEIN)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 6 SER A 998
ASP A 999
ARG A 974
GLU A 980
None
0.95A 4eysA-2qf7A:
2.6
4eysA-2qf7A:
14.42
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.
4K87_A_ADNA602_1
(PROLINE--TRNA LIGASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 8 ARG A  17
GLN A 220
GLY A 280
THR A 281
None
0.99A 4k87A-2qf7A:
3.0
4k87A-2qf7A:
18.65
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.
4KEB_B_FOLB202_0
(DIHYDROFOLATE
REDUCTASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ILE A 381
ALA A 376
GLN A 351
ILE A 442
LEU A 350
None
1.10A 4kebB-2qf7A:
undetectable
4kebB-2qf7A:
10.71
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.
4KMU_C_RFPC1401_1
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 GLN A 783
ASP A 719
HIS A 747
SER A 553
LEU A 554
ZN  A1157 ( 4.5A)
None
ZN  A1157 (-3.3A)
None
None
1.34A 4kmuC-2qf7A:
4.2
4kmuC-2qf7A:
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.
4KMU_H_RFPH1401_1
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 GLN A 783
ASP A 719
HIS A 747
SER A 553
LEU A 554
ZN  A1157 ( 4.5A)
None
ZN  A1157 (-3.3A)
None
None
1.38A 4kmuH-2qf7A:
5.6
4kmuH-2qf7A:
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.
4L64_A_C2FA802_0
(5-METHYLTETRAHYDROPT
EROYLTRIGLUTAMATE--H
OMOCYSTEINE
METHYLTRANSFERASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 7 SER A 238
TYR A 452
ARG A 249
VAL A 217
None
1.47A 4l64A-2qf7A:
8.7
4l64A-2qf7A:
22.61
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.
4LV9_A_20JA602_1
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 7 TYR A 700
ILE A 744
ILE A 715
ALA A 704
None
0.89A 4lv9A-2qf7A:
2.4
4lv9A-2qf7A:
19.08
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.
4LV9_B_20JB602_1
(NICOTINAMIDE
PHOSPHORIBOSYLTRANSF
ERASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 7 TYR A 700
ILE A 744
ILE A 715
ALA A 704
None
0.88A 4lv9B-2qf7A:
2.4
4lv9B-2qf7A:
19.08
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.
4MV7_A_PPFA501_1
(BIOTIN CARBOXYLASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
6 / 7 LYS A 245
ASN A 299
ARG A 301
GLN A 303
VAL A 304
GLU A 305
AGS  A1162 (-3.5A)
AGS  A1162 ( 3.7A)
None
None
None
None
0.84A 4mv7A-2qf7A:
54.8
4mv7A-2qf7A:
21.56
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4NKX_C_STRC601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 5 ILE A1034
ARG A 429
ASP A 471
VAL A1006
None
0.84A 4nkxC-2qf7A:
undetectable
4nkxC-2qf7A:
19.04
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.
4NKX_D_STRD601_2
(STEROID
17-ALPHA-HYDROXYLASE
/17,20 LYASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 5 ILE A1034
ARG A 429
ASP A 471
VAL A1006
None
0.85A 4nkxD-2qf7A:
undetectable
4nkxD-2qf7A:
19.04
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.
4OJB_A_198A1001_2
(ANDROGEN RECEPTOR)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 7 LEU A1136
ILE A1115
ILE A1095
VAL A1113
None
0.86A 4ojbA-2qf7A:
undetectable
4ojbA-2qf7A:
12.70
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.
4P6V_E_RBFE201_1
(NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT B
NA(+)-TRANSLOCATING
NADH-QUINONE
REDUCTASE SUBUNIT E)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 5 HIS A 216
VAL A 217
GLU A 218
LYS A 245
AGS  A1162 (-3.9A)
None
None
AGS  A1162 (-3.5A)
1.04A 4p6vB-2qf7A:
3.7
4p6vE-2qf7A:
undetectable
4p6vB-2qf7A:
16.28
4p6vE-2qf7A:
10.87
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.
4RET_C_DGXC2005_1
(SODIUM/POTASSIUM-TRA
NSPORTING ATPASE
SUBUNIT ALPHA-1)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 GLU A 602
ASP A 599
LEU A 616
ALA A 982
PHE A 979
None
1.06A 4retC-2qf7A:
2.9
4retC-2qf7A:
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.
4RVD_A_SAMA502_0
(D-MYCAROSE
3-C-METHYLTRANSFERAS
E)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ILE A 681
ALA A 728
HIS A 747
VAL A 717
ILE A 744
None
None
ZN  A1157 (-3.3A)
KCX  A 718 ( 3.1A)
None
1.11A 4rvdA-2qf7A:
3.4
4rvdA-2qf7A:
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.
4S0V_A_SUVA2001_1
(HUMAN OREXIN
RECEPTOR TYPE 2
FUSION PROTEIN TO P.
ABYSII GLYCOGEN
SYNTHASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 THR A 882
VAL A 881
THR A 588
VAL A 591
GLU A 582
None
1.32A 4s0vA-2qf7A:
undetectable
4s0vA-2qf7A:
18.31
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4U15_A_0HKA2001_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M3,LYSOZYME,MUSCARIN
IC ACETYLCHOLINE
RECEPTOR M3)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ASP A1043
SER A1040
THR A 478
ALA A 481
ASN A 486
None
1.44A 4u15A-2qf7A:
undetectable
4u15A-2qf7A:
16.64
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.
4XP6_A_B40A601_1
(TRANSPORTER)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 5 ASP A 655
VAL A 636
ASP A 633
GLY A 953
None
1.20A 4xp6A-2qf7A:
undetectable
4xp6A-2qf7A:
18.62
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.
4Z7F_A_FOLA201_0
(FOLATE ECF
TRANSPORTER)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 LEU A 985
MET A 618
ALA A 643
PHE A 589
THR A 588
None
1.18A 4z7fA-2qf7A:
0.0
4z7fA-2qf7A:
10.64
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.
5DSG_A_0HKA1201_1
(MUSCARINIC
ACETYLCHOLINE
RECEPTOR
M4,ENDOLYSIN,ENDOLYS
IN,MUSCARINIC
ACETYLCHOLINE
RECEPTOR M4)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ASP A1043
SER A1040
THR A 478
ALA A 481
ASN A 486
None
1.42A 5dsgA-2qf7A:
1.8
5dsgA-2qf7A:
16.52
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.
5IKR_A_ID8A601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 ARG A 421
VAL A 405
LEU A 383
TYR A 373
ALA A 376
None
1.18A 5ikrA-2qf7A:
undetectable
5ikrA-2qf7A:
18.66
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5K9D_A_ACTA405_0
(DIHYDROOROTATE
DEHYDROGENASE
(QUINONE),
MITOCHONDRIAL)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
3 / 3 GLN A 351
THR A 307
ASP A 384
None
0.92A 5k9dA-2qf7A:
7.4
5k9dA-2qf7A:
17.57
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.
5M8R_C_MMSC516_1
(5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 8 HIS A 747
HIS A 749
GLY A 842
SER A 553
ZN  A1157 (-3.3A)
ZN  A1157 (-3.3A)
None
None
0.97A 5m8rC-2qf7A:
undetectable
5m8rC-2qf7A:
15.27
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.
5ND2_B_TA1B601_1
(TUBULIN BETA-2B
CHAIN)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 12 VAL A  30
ASP A  47
GLU A  48
ALA A  83
SER A  81
None
1.43A 5nd2B-2qf7A:
undetectable
5nd2B-2qf7A:
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.
5TUD_A_ERMA2001_2
(5-HYDROXYTRYPTAMINE
RECEPTOR 2B,SOLUBLE
CYTOCHROME B562
CHIMERA)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 7 THR A 561
LEU A 476
VAL A 483
GLU A1021
None
1.11A 5tudA-2qf7A:
undetectable
5tudA-2qf7A:
17.64
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5U63_A_ACTA406_0
(THIOREDOXIN
REDUCTASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
3 / 3 HIS A 749
SER A 782
ARG A 548
ZN  A1157 (-3.3A)
None
KCX  A 718 ( 3.6A)
0.96A 5u63A-2qf7A:
2.7
5u63A-2qf7A:
13.81
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.
5UUN_B_ACTB309_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
3 / 3 TYR A 452
ALA A 252
TYR A 254
None
0.70A 5uunB-2qf7A:
undetectable
5uunB-2qf7A:
13.79
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.
5Z84_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
3 / 3 TYR A 452
ARG A 215
THR A 454
None
None
AGS  A1162 (-3.5A)
0.80A 5z84J-2qf7A:
undetectable
5z84J-2qf7A:
5.21
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5ZJI_B_PQNB842_1
(PHOTOSYSTEM I P700
CHLOROPHYLL A
APOPROTEIN A2)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
5 / 10 ILE A   3
TRP A  33
ILE A  14
ALA A  15
ALA A  31
None
1.47A 5zjiB-2qf7A:
undetectable
5zjiB-2qf7A:
6.48
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.
6BRD_B_RFPB502_2
(RIFAMPIN
MONOOXYGENASE)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 6 GLN A 351
VAL A 311
LEU A 438
ARG A 424
None
1.11A 6brdB-2qf7A:
undetectable
6brdB-2qf7A:
6.05
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.
6CDU_A_EY4A502_0
(CHIMERIC ALPHA1GABAA
RECEPTOR)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 7 ALA A 481
THR A 478
TYR A 479
VAL A 485
None
0.95A 6cduA-2qf7A:
undetectable
6cduE-2qf7A:
undetectable
6cduA-2qf7A:
13.75
6cduE-2qf7A:
13.75
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.
6CDU_H_EY4H500_0
(CHIMERIC ALPHA1GABAA
RECEPTOR)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 7 VAL A 485
ALA A 481
THR A 478
TYR A 479
None
0.92A 6cduH-2qf7A:
undetectable
6cduI-2qf7A:
undetectable
6cduH-2qf7A:
13.75
6cduI-2qf7A:
13.75
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.
6MN4_E_AM2E301_0
(AMINOGLYCOSIDE
N(3)-ACETYLTRANSFERA
SE, AAC(3)-IVA)
2qf7 PYRUVATE CARBOXYLASE
PROTEIN

(Rhizobium
etli)
4 / 7 HIS A 745
THR A 543
ARG A 737
ASP A 768
None
None
None
MG  A1158 (-3.5A)
1.26A 6mn4E-2qf7A:
undetectable
6mn4E-2qf7A:
12.45