SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1kqf'

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.
1A29_A_TFPA153_1
(CALMODULIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 8 GLU A 598
ILE A 972
LEU A 991
ALA A 949
VAL A 920
 None
 1.27A 1a29A-1kqfA:
undetectable		 1a29A-1kqfA:
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.
1GTI_C_CCSC47_0
(GLUTATHIONE
S-TRANSFERASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
CYTOCHROME B556(FDN)
SUBUNIT
(Escherichia
coli) 		4 / 6 TRP C 192
THR C  10
LYS C 108
TYR C 109
 None
None
None
HEM  C 810 (-3.8A)
 1.29A 1gtiC-1kqfC:
undetectable		 1gtiC-1kqfC:
21.05
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.
1GTN_J_TRPJ81_0
(TRP RNA-BINDING
ATTENUATION PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 8 ALA A 253
GLY A 439
ALA A 247
THR A 405
ILE A 220
 None
 1.31A 1gtnI-1kqfA:
undetectable
1gtnJ-1kqfA:
undetectable		 1gtnI-1kqfA:
5.42
1gtnJ-1kqfA:
5.42
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.
1JNO_A_DVAA6_0
(GRAMICIDIN A)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 ALA A 115
VAL A 611
TRP A 593
 None
 0.91A 1jnoA-1kqfA:
undetectable		 1jnoA-1kqfA:
2.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1JNO_B_DVAB6_0
(GRAMICIDIN A)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 ALA A 115
VAL A 611
TRP A 593
 None
 0.90A 1jnoB-1kqfA:
undetectable		 1jnoB-1kqfA:
2.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MAG_A_DVAA6_0
(GRAMICIDIN A)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 ALA A 115
VAL A 611
TRP A 593
 None
 0.92A 1magA-1kqfA:
undetectable		 1magA-1kqfA:
2.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MAG_B_DVAB6_0
(GRAMICIDIN A)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 ALA A 115
VAL A 611
TRP A 593
 None
 0.92A 1magB-1kqfA:
undetectable		 1magB-1kqfA:
2.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1MRL_A_DOLA300_1
(STREPTOGRAMIN A
ACETYLTRANSFERASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 11 TYR A 540
LEU A 576
PRO A 559
LEU A 164
ASP A 140
 None
 1.32A 1mrlA-1kqfA:
0.0
1mrlB-1kqfA:
0.1		 1mrlA-1kqfA:
11.76
1mrlB-1kqfA:
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.
1MX1_D_THAD4_2
(LIVER
CARBOXYLESTERASE I)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 PHE A 825
LEU A 430
MET A 425
 None
 0.78A 1mx1D-1kqfA:
undetectable		 1mx1D-1kqfA:
19.77
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.
1NW3_A_ACTA600_0
(HISTONE
METHYLTRANSFERASE
DOT1L)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 5 LEU A 430
VAL A 302
TYR A 301
THR A 306
 None
 1.44A 1nw3A-1kqfA:
undetectable		 1nw3A-1kqfA:
16.37
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.
1ONI_I_BEZI518_0
(14.5 KDA
TRANSLATIONAL
INHIBITOR PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 7 ILE A 798
GLY A 807
PRO A 790
ASN A 801
 None
 0.92A 1oniG-1kqfA:
undetectable
1oniI-1kqfA:
undetectable		 1oniG-1kqfA:
9.32
1oniI-1kqfA:
9.32
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.
1WRL_C_TFPC208_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 5 PHE A 180
LEU A 675
PHE A 553
SER A 160
 None
 1.11A 1wrlC-1kqfA:
undetectable		 1wrlC-1kqfA:
6.72
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.
1XZX_X_T3X500_1
(THYROID HORMONE
RECEPTOR BETA-1)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
CYTOCHROME B556(FDN)
SUBUNIT
(Escherichia
coli) 		5 / 12 ILE C 163
ILE C 166
ALA C 165
MET C 116
LEU C  68
 CDL  C 812 ( 4.9A)
HEM  C 810 (-4.0A)
None
None
None
 1.26A 1xzxX-1kqfC:
0.8		 1xzxX-1kqfC:
20.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
1Y0X_X_T44X500_2
(THYROID HORMONE
RECEPTOR BETA-1)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 5 ILE A 810
SER A 721
LEU A 773
ASN A 774
 None
 1.13A 1y0xX-1kqfA:
0.0		 1y0xX-1kqfA:
14.89
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.
2F16_2_BO221405_1
(PROTEASOME COMPONENT
PRE3)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 11 THR A 403
THR A 404
THR A 405
ALA A 223
GLY A 433
 None
 0.93A 2f162-1kqfA:
undetectable		 2f162-1kqfA:
11.71
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.
2F16_N_BO2N1404_1
(PROTEASOME COMPONENT
PRE3)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 11 THR A 403
THR A 404
THR A 405
ALA A 223
GLY A 433
 None
 0.93A 2f16N-1kqfA:
undetectable		 2f16N-1kqfA:
11.71
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.
2J2P_D_SC2D1290_1
(FICOLIN-2)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 5 GLY A 630
TRP A 632
TRP A 771
ARG A 631
 None
 1.01A 2j2pD-1kqfA:
0.0
2j2pF-1kqfA:
0.0		 2j2pD-1kqfA:
12.12
2j2pF-1kqfA:
12.12
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.
2OKC_B_SAMB500_1
(TYPE I RESTRICTION
ENZYME STYSJI M
PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 6 THR A 416
THR A1002
ASP A 536
THR A 534
 None
 1.19A 2okcB-1kqfA:
undetectable		 2okcB-1kqfA:
17.79
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.
2XCT_G_CPFG1020_1
(DNA GYRASE SUBUNIT
B, DNA GYRASE
SUBUNIT A)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 ARG A 210
GLY A 211
SER A 463
 None
 0.58A 2xctB-1kqfA:
undetectable		 2xctB-1kqfA:
22.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2Y7K_A_SALA1303_1
(LYSR-TYPE REGULATORY
PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
CYTOCHROME B556(FDN)
SUBUNIT
(Escherichia
coli) 		4 / 7 PRO C  58
ILE C  62
GLY C 131
TRP C 135
 HEM  C 809 (-4.2A)
None
HEM  C 809 (-3.7A)
None
 0.68A 2y7kA-1kqfC:
undetectable		 2y7kA-1kqfC:
20.50
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.
3APW_B_DP0B190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 PHE A 619
GLU A 621
GLN A 640
ARG A 107
ALA A 908
 None
 1.07A 3apwB-1kqfA:
undetectable		 3apwB-1kqfA:
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.
3BGD_A_PM6A302_1
(THIOPURINE
S-METHYLTRANSFERASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 6 HIS A 237
PHE A 241
LEU A 445
LEU A 407
 MGD  A1019 ( 4.5A)
None
None
None
 0.79A 3bgdA-1kqfA:
2.7		 3bgdA-1kqfA:
12.81
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.
3BGD_B_PM6B302_1
(THIOPURINE
S-METHYLTRANSFERASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 7 HIS A 237
PHE A 241
LEU A 445
LEU A 407
 MGD  A1019 ( 4.5A)
None
None
None
 0.79A 3bgdB-1kqfA:
2.6		 3bgdB-1kqfA:
12.81
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.
3BXO_B_SAMB238_1
(N,N-DIMETHYLTRANSFER
ASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 TYR A  76
GLU A  45
ASP A  83
 None
 0.87A 3bxoB-1kqfA:
undetectable		 3bxoB-1kqfA:
13.15
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.
3D4S_A_TIMA401_2
(BETA-2 ADRENERGIC
RECEPTOR/T4-LYSOZYME
CHIMERA)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 THR A 550
SER A 160
PHE A 553
 None
 0.70A 3d4sA-1kqfA:
0.0		 3d4sA-1kqfA:
19.31
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.
3FSU_A_C2FA995_0
(5,10-METHYLENETETRAH
YDROFOLATE REDUCTASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 GLN A 429
ASN A 294
LEU A 394
THR A 404
ARG A 289
 None
 1.37A 3fsuA-1kqfA:
undetectable		 3fsuA-1kqfA:
15.43
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.
3HS6_B_EPAB1_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 PHE A 946
GLY A 945
ASN A 567
GLY A 597
SER A 599
 None
 1.02A 3hs6B-1kqfA:
0.0		 3hs6B-1kqfA:
21.31
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.
3MEK_A_SAMA510_0
(SET AND MYND
DOMAIN-CONTAINING
PROTEIN 3)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 GLY A 980
ASN A 106
GLU A 979
ASN A 558
HIS A 975
 None
None
None
None
MGD  A1019 (-4.8A)
 1.49A 3mekA-1kqfA:
undetectable		 3mekA-1kqfA:
18.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3MG0_2_BO221405_1
(PROTEASOME COMPONENT
PRE3
PROTEASOME COMPONENT
PUP1)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 THR A 403
THR A 404
THR A 405
ALA A 223
GLY A 433
 None
 0.96A 3mg02-1kqfA:
undetectable
3mg0V-1kqfA:
undetectable		 3mg02-1kqfA:
11.71
3mg0V-1kqfA:
13.03
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.
3MG0_N_BO2N1404_1
(PROTEASOME COMPONENT
PRE3)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 11 THR A 403
THR A 404
THR A 405
ALA A 223
GLY A 433
 None
 0.95A 3mg0N-1kqfA:
undetectable		 3mg0N-1kqfA:
11.71
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.
3QOW_A_SAMA417_1
(HISTONE-LYSINE
N-METHYLTRANSFERASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 THR A 893
ASP A 259
GLU A 235
 MGD  A1019 (-3.6A)
MGD  A1019 (-3.0A)
None
 0.76A 3qowA-1kqfA:
undetectable		 3qowA-1kqfA:
16.83
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.
3QWP_A_SAMA510_0
(SET AND MYND
DOMAIN-CONTAINING
PROTEIN 3)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 GLY A 980
ASN A 106
GLU A 979
ASN A 558
HIS A 975
 None
None
None
None
MGD  A1019 (-4.8A)
 1.47A 3qwpA-1kqfA:
undetectable		 3qwpA-1kqfA:
18.16
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3T3R_B_9PLB501_1
(CYTOCHROME P450 2A6)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 9 PHE A 208
ASN A 434
GLY A 441
THR A 214
PHE A 825
 None
 1.28A 3t3rB-1kqfA:
0.0		 3t3rB-1kqfA:
18.96
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.
3UG8_A_IMNA2001_1
(ALDO-KETO REDUCTASE
FAMILY 1 MEMBER C3)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 LEU A 459
SER A 511
SER A 734
PRO A 688
TYR A 682
 None
 1.49A 3ug8A-1kqfA:
undetectable		 3ug8A-1kqfA:
14.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3ZTV_A_ADNA1600_1
(NAD NUCLEOTIDASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 9 ASN A 215
GLY A 440
GLY A 441
GLY A 439
ASP A 219
 None
 1.24A 3ztvA-1kqfA:
undetectable		 3ztvA-1kqfA:
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.
4AN2_A_EUIA1382_2
(DUAL SPECIFICITY
MITOGEN-ACTIVATED
PROTEIN KINASE
KINASE 1)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 4 ASN A 144
SER A 461
LEU A 187
THR A 550
 None
 1.31A 4an2A-1kqfA:
undetectable		 4an2A-1kqfA:
14.98
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.
4DF3_A_SAMA301_0
(FIBRILLARIN-LIKE
RRNA/TRNA
2'-O-METHYLTRANSFERA
SE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 THR A 403
ALA A 444
VAL A 442
ALA A 233
VAL A 228
 None
 1.45A 4df3A-1kqfA:
3.0		 4df3A-1kqfA:
11.68
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.
4EJJ_A_NCTA501_1
(CYTOCHROME P450 2A6)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 7 PHE A 208
ASN A 434
GLY A 441
THR A 214
PHE A 825
 None
 1.48A 4ejjA-1kqfA:
undetectable		 4ejjA-1kqfA:
18.96
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.
4EJJ_B_NCTB501_1
(CYTOCHROME P450 2A6)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 7 PHE A 208
ASN A 434
GLY A 441
THR A 214
PHE A 825
 None
 1.49A 4ejjB-1kqfA:
0.0		 4ejjB-1kqfA:
18.96
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.
4FAK_A_SAMA201_0
(RIBOSOMAL RNA LARGE
SUBUNIT
METHYLTRANSFERASE H)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
CYTOCHROME B556(FDN)
SUBUNIT
(Escherichia
coli) 		5 / 10 ILE C 134
ILE C  62
GLY C  61
PHE C 139
THR C 130
 HEM  C 809 (-4.8A)
None
HEM  C 809 (-3.5A)
None
None
 0.86A 4fakA-1kqfC:
undetectable		 4fakA-1kqfC:
20.28
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4FIA_A_0U9A601_1
(CHOLESTEROL
24-HYDROXYLASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 TYR A 290
LEU A 291
VAL A 287
THR A 404
THR A 397
 None
 1.04A 4fiaA-1kqfA:
0.0		 4fiaA-1kqfA:
19.15
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.
4FIA_A_198A602_1
(CHOLESTEROL
24-HYDROXYLASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 TYR A 290
LEU A 291
VAL A 287
THR A 404
THR A 397
 None
 1.04A 4fiaA-1kqfA:
0.0		 4fiaA-1kqfA:
19.15
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.
4FUB_A_ACTA311_0
(UROKINASE-TYPE
PLASMINOGEN
ACTIVATOR)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 TYR A1005
ARG A 896
HIS A 902
 MGD  A1018 (-3.3A)
MGD  A1018 ( 3.3A)
MGD  A1018 ( 3.7A)
 1.05A 4fubA-1kqfA:
0.0		 4fubA-1kqfA:
13.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4G2Z_A_ID8A711_1
(LACTOTRANSFERRIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 PRO A 870
TYR A 326
GLY A 321
 None
 0.75A 4g2zA-1kqfA:
undetectable		 4g2zA-1kqfA:
16.25
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.
4H2F_A_ADNA601_1
(5'-NUCLEOTIDASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 9 ASN A 215
GLY A 440
GLY A 441
GLY A 439
ASP A 219
 None
 1.11A 4h2fA-1kqfA:
undetectable		 4h2fA-1kqfA:
20.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4H2G_A_ADNA603_1
(5'-NUCLEOTIDASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 9 ASN A 215
GLY A 440
GLY A 441
GLY A 439
ASP A 219
 None
 1.23A 4h2gA-1kqfA:
undetectable		 4h2gA-1kqfA:
20.76
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JKS_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.04A 4jksA-1kqfA:
undetectable		 4jksA-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JKS_B_ADNB401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.04A 4jksB-1kqfA:
undetectable		 4jksB-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4JKU_A_ADNA500_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.02A 4jkuA-1kqfA:
undetectable		 4jkuA-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K8C_A_ADNA401_1
(SUGAR KINASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.04A 4k8cA-1kqfA:
undetectable		 4k8cA-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K8C_B_ADNB401_1
(SUGAR KINASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.04A 4k8cB-1kqfA:
undetectable		 4k8cB-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K8K_A_ADNA401_1
(SUGAR KINASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.04A 4k8kA-1kqfA:
undetectable		 4k8kA-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K8K_B_ADNB403_1
(SUGAR KINASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.03A 4k8kB-1kqfA:
undetectable		 4k8kB-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KAH_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.04A 4kahA-1kqfA:
undetectable		 4kahA-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KAH_B_ADNB502_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.04A 4kahB-1kqfA:
undetectable		 4kahB-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KAL_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.03A 4kalA-1kqfA:
undetectable		 4kalA-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KAN_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.04A 4kanA-1kqfA:
undetectable		 4kanA-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KAN_B_ADNB401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.05A 4kanB-1kqfA:
undetectable		 4kanB-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KBE_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.04A 4kbeA-1kqfA:
undetectable		 4kbeA-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4KBE_B_ADNB401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.03A 4kbeB-1kqfA:
undetectable		 4kbeB-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LBG_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.04A 4lbgA-1kqfA:
undetectable		 4lbgA-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LBG_B_ADNB401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.04A 4lbgB-1kqfA:
undetectable		 4lbgB-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LCA_A_ADNA401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.04A 4lcaA-1kqfA:
undetectable		 4lcaA-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4LCA_B_ADNB401_1
(PROBABLE SUGAR
KINASE PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ASN A 628
ASP A 456
GLY A 453
ASN A 171
ILE A 738
 None
 1.05A 4lcaB-1kqfA:
undetectable		 4lcaB-1kqfA:
17.29
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MBS_B_MRVB1101_2
(CHIMERA PROTEIN OF
C-C CHEMOKINE
RECEPTOR TYPE 5 AND
RUBREDOXIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 5 THR A 200
LEU A 204
THR A 306
MET A 832
 None
 1.47A 4mbsB-1kqfA:
0.0		 4mbsB-1kqfA:
17.50
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.
4ODR_B_FK5B201_1
(PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
SLYD,
PEPTIDYL-PROLYL
CIS-TRANS ISOMERASE
FKBP1A CHIMERA)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 11 LEU A 835
LEU A 432
LEU A 291
ILE A 292
LEU A 288
 None
 1.05A 4odrA-1kqfA:
undetectable
4odrB-1kqfA:
undetectable		 4odrA-1kqfA:
7.06
4odrB-1kqfA:
7.06
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.
4P6S_A_DAHA304_1
(TYROSINASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 5 ASN A 860
LEU A 862
HIS A 863
THR A 282
 None
 1.25A 4p6sA-1kqfA:
0.0		 4p6sA-1kqfA:
14.62
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.
4QVN_B_BO2B201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 THR A 403
THR A 404
THR A 405
ALA A 223
GLY A 433
 None
 0.89A 4qvnV-1kqfA:
undetectable
4qvnb-1kqfA:
undetectable		 4qvnV-1kqfA:
13.29
4qvnb-1kqfA:
11.71
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.
4QVN_N_BO2N201_1
(PROTEASOME SUBUNIT
BETA TYPE-2
PROTEASOME SUBUNIT
BETA TYPE-1)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 THR A 403
THR A 404
THR A 405
ALA A 223
GLY A 433
 None
 0.88A 4qvnH-1kqfA:
undetectable
4qvnN-1kqfA:
undetectable		 4qvnH-1kqfA:
13.29
4qvnN-1kqfA:
11.71
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.
4ZAU_A_YY3A1101_1
(EPIDERMAL GROWTH
FACTOR RECEPTOR)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 8 GLY A 441
VAL A 442
ALA A 444
LEU A 445
GLY A 630
 None
 1.22A 4zauA-1kqfA:
undetectable		 4zauA-1kqfA:
16.02
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.
5AXA_A_ADNA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 5 THR A 455
THR A1002
HIS A 415
LEU A 410
 None
None
MGD  A1019 (-3.9A)
MGD  A1019 ( 3.4A)
 1.22A 5axaA-1kqfA:
undetectable		 5axaA-1kqfA:
18.06
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.
5AXA_C_ADNC502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 5 THR A 455
THR A1002
HIS A 415
LEU A 410
 None
None
MGD  A1019 (-3.9A)
MGD  A1019 ( 3.4A)
 1.27A 5axaC-1kqfA:
undetectable		 5axaC-1kqfA:
18.06
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.
5CCL_A_SAMA504_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SMYD3)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 GLY A 980
ASN A 106
GLU A 979
ASN A 558
HIS A 975
 None
None
None
None
MGD  A1019 (-4.8A)
 1.48A 5cclA-1kqfA:
undetectable		 5cclA-1kqfA:
18.02
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.
5DB5_A_CYSA503_0
(CYSTEINE DESULFURASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 8 ALA A 419
HIS A 415
ASN A 421
THR A1002
 None
MGD  A1019 (-3.9A)
None
None
 1.32A 5db5A-1kqfA:
2.1
5db5B-1kqfA:
undetectable		 5db5A-1kqfA:
17.42
5db5B-1kqfA:
17.42
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.
5FA8_A_SAMA301_1
(RIBOSOMAL PROTEIN
L11
METHYLTRANSFERASE,
PUTATIVE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 THR A 893
ASP A 259
GLU A 235
 MGD  A1019 (-3.6A)
MGD  A1019 (-3.0A)
None
 0.77A 5fa8A-1kqfA:
2.4		 5fa8A-1kqfA:
9.74
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.
5HFJ_F_SAMF301_0
(ADENINE SPECIFIC DNA
METHYLTRANSFERASE
(DPNA))		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 ALA A 620
PRO A 584
GLN A 192
GLY A 168
SER A 167
 None
MGD  A1018 (-4.1A)
MGD  A1018 (-3.7A)
MGD  A1018 ( 4.8A)
None
 1.31A 5hfjF-1kqfA:
2.5		 5hfjF-1kqfA:
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.
5IMS_B_ACTB713_0
(ACETOLACTATE
SYNTHASE CATALYTIC
SUBUNIT,
MITOCHONDRIAL)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 GLY A 977
GLN A 918
LYS A 906
 None
 0.73A 5imsB-1kqfA:
5.8		 5imsB-1kqfA:
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.
5JWA_A_ACTA609_0
(NADH DEHYDROGENASE,
PUTATIVE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		3 / 3 VAL A 611
SER A 590
TRP A 593
 None
 1.05A 5jwaA-1kqfA:
undetectable		 5jwaA-1kqfA:
19.02
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.
5LF7_B_6V8B304_0
(PROTEASOME SUBUNIT
BETA TYPE-6
PROTEASOME SUBUNIT
BETA TYPE-7)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 THR A 403
THR A 404
THR A 405
ALA A 223
GLY A 433
 None
 0.85A 5lf7V-1kqfA:
undetectable
5lf7b-1kqfA:
undetectable		 5lf7V-1kqfA:
12.29
5lf7b-1kqfA:
11.23
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.
5LF7_N_6V8N305_0
(PROTEASOME SUBUNIT
BETA TYPE-6
PROTEASOME SUBUNIT
BETA TYPE-7)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 THR A 403
THR A 404
THR A 405
ALA A 223
GLY A 433
 None
 0.84A 5lf7H-1kqfA:
undetectable
5lf7N-1kqfA:
undetectable		 5lf7H-1kqfA:
12.29
5lf7N-1kqfA:
11.23
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.
5M8N_A_MMSA514_1
(5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 10 HIS A 636
ASN A  48
LEU A  59
THR A  51
SER A 449
 None
 1.20A 5m8nA-1kqfA:
undetectable		 5m8nA-1kqfA:
17.80
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.
5M8N_B_MMSB515_1
(5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 10 HIS A 636
ASN A  48
LEU A  59
THR A  51
SER A 449
 None
 1.22A 5m8nB-1kqfA:
0.0		 5m8nB-1kqfA:
17.80
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.
5M8R_A_MMSA511_1
(5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 7 HIS A 636
ASN A  48
LEU A  59
SER A 449
 None
 1.05A 5m8rA-1kqfA:
0.0		 5m8rA-1kqfA:
17.80
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.
5M8R_B_MMSB514_1
(5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 8 SER A 104
ASN A 106
LEU A 585
SER A 590
 None
None
MGD  A1018 (-4.0A)
None
 0.91A 5m8rB-1kqfA:
0.0		 5m8rB-1kqfA:
17.80
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.
5M8R_D_MMSD509_1
(5,6-DIHYDROXYINDOLE-
2-CARBOXYLIC ACID
OXIDASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 8 SER A 104
ASN A 106
LEU A 585
SER A 590
 None
None
MGD  A1018 (-4.0A)
None
 0.93A 5m8rD-1kqfA:
undetectable		 5m8rD-1kqfA:
17.80
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.
5NWV_A_ACAA18_1
(SCRFP-TAG,GP41)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 LEU A 311
LYS A 303
ASN A 362
LEU A 364
LEU A 835
 None
 1.22A 5nwvA-1kqfA:
0.0		 5nwvA-1kqfA:
4.26
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5V37_A_SAMA504_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SMYD3)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 GLY A 980
ASN A 106
GLU A 979
ASN A 558
HIS A 975
 None
None
None
None
MGD  A1019 (-4.8A)
 1.46A 5v37A-1kqfA:
undetectable		 5v37A-1kqfA:
17.91
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5XXD_A_SAMA501_0
(SMYD3
METHYLTRANSFERASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 GLY A 980
ASN A 106
GLU A 979
ASN A 558
HIS A 975
 None
None
None
None
MGD  A1019 (-4.8A)
 1.48A 5xxdA-1kqfA:
undetectable		 5xxdA-1kqfA:
17.87
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.
5XXG_A_SAMA502_0
(SMYD3)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 GLY A 980
ASN A 106
GLU A 979
ASN A 558
HIS A 975
 None
None
None
None
MGD  A1019 (-4.8A)
 1.47A 5xxgA-1kqfA:
undetectable		 5xxgA-1kqfA:
17.87
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.
5XXJ_A_SAMA505_0
(SMYD3)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 GLY A 980
ASN A 106
GLU A 979
ASN A 558
HIS A 975
 None
None
None
None
MGD  A1019 (-4.8A)
 1.47A 5xxjA-1kqfA:
undetectable		 5xxjA-1kqfA:
17.87
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.
5YJO_A_SAMA505_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
SMYD3)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 GLY A 980
ASN A 106
GLU A 979
ASN A 558
HIS A 975
 None
None
None
None
MGD  A1019 (-4.8A)
 1.47A 5yjoA-1kqfA:
undetectable		 5yjoA-1kqfA:
17.87
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.
5ZRF_D_EVPD101_1
()		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 5 GLY A 453
ASP A 456
ARG A 446
GLN A 634
 None
 1.36A 5zrfB-1kqfA:
undetectable		 5zrfB-1kqfA:
21.77
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.
6AG0_A_ACRA605_0
(ALPHA-AMYLASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 8 ASP A  81
ASP A  83
HIS A  84
PRO A  85
 None
 0.80A 6ag0A-1kqfA:
undetectable		 6ag0A-1kqfA:
5.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6AG0_C_ACRC605_0
(ALPHA-AMYLASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 8 ASP A  81
ASP A  83
HIS A  84
PRO A  85
 None
 0.84A 6ag0C-1kqfA:
undetectable		 6ag0C-1kqfA:
5.90
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6EBP_C_DAHC123_0
(RIBONUCLEOSIDE-DIPHO
SPHATE REDUCTASE,
BETA SUBUNIT)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 10 PHE A 180
ASP A 649
GLY A 655
ILE A 656
ILE A 582
 None
MGD  A1018 (-2.9A)
None
None
MGD  A1018 (-4.5A)
 1.19A 6ebpC-1kqfA:
undetectable		 6ebpC-1kqfA:
5.20
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
6G9B_B_IXXB705_1
(ENVELOPE
GLYCOPROTEIN,ENVELOP
E GLYCOPROTEIN
ENVELOPE
GLYCOPROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 5 ARG A 937
ALA A1015
GLN A 918
ILE A 947
 None
 1.39A 6g9bA-1kqfA:
0.0
6g9bB-1kqfA:
0.4		 6g9bA-1kqfA:
10.84
6g9bB-1kqfA:
7.14
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.
6H3D_A_DHIA601_0
(DUF2338
DOMAIN-CONTAINING
PROTEIN)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		4 / 5 TYR A 305
ASN A 780
TYR A 779
PHE A 825
 None
 1.50A 6h3dA-1kqfA:
1.3		 6h3dA-1kqfA:
18.12
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.
6HU9_H_PCFH604_0
(CYTOCHROME B-C1
COMPLEX SUBUNIT 8
CYTOCHROME C OXIDASE
POLYPEPTIDE 5A,
MITOCHONDRIAL)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
CYTOCHROME B556(FDN)
SUBUNIT
(Escherichia
coli) 		5 / 8 GLY C  61
PHE C  60
VAL C  21
GLY C  32
SER C  31
 HEM  C 809 (-3.5A)
None
None
HEM  C 809 (-3.4A)
None
 1.49A 6hu9H-1kqfC:
undetectable
6hu9e-1kqfC:
0.6		 6hu9H-1kqfC:
16.59
6hu9e-1kqfC:
15.21
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.
6HWD_B_BO2B201_0
(PROTEASOME SUBUNIT
BETA TYPE-1
PROTEASOME SUBUNIT
BETA TYPE-2)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 THR A 403
THR A 404
THR A 405
ALA A 223
GLY A 433
 None
 0.89A 6hwdV-1kqfA:
undetectable
6hwdb-1kqfA:
undetectable		 6hwdV-1kqfA:
5.61
6hwdb-1kqfA:
6.27
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.
6HWD_N_BO2N201_0
(PROTEASOME SUBUNIT
BETA TYPE-1
PROTEASOME SUBUNIT
BETA TYPE-2)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 THR A 403
THR A 404
THR A 405
ALA A 223
GLY A 433
 None
 0.89A 6hwdH-1kqfA:
undetectable
6hwdN-1kqfA:
undetectable		 6hwdH-1kqfA:
5.61
6hwdN-1kqfA:
6.27
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.
6QXS_D_FOZD403_0
(THYMIDYLATE SYNTHASE)		 1kqf FORMATE
DEHYDROGENASE,
NITRATE-INDUCIBLE,
MAJOR SUBUNIT
(Escherichia
coli) 		5 / 12 LEU A 445
LEU A 204
GLY A 211
ILE A 422
ALA A 419
 None
 1.33A 6qxsD-1kqfA:
0.0		 6qxsD-1kqfA:
14.47