SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1krh'

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.
2OA1_B_ADNB2005_1
(TRYPTOPHAN
HALOGENASE)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		4 / 7 GLY A 218
GLY A 219
VAL A 316
LEU A 306
 None
SO4  A 402 (-3.5A)
None
None
 0.60A 2oa1B-1krhA:
3.7		 2oa1B-1krhA:
20.36
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2XCT_H_CPFH1020_1
(DNA GYRASE SUBUNIT
B, DNA GYRASE
SUBUNIT A)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		3 / 3 ARG A  50
GLU A  74
SER A 157
 None
None
FAD  A 501 (-4.0A)
 0.81A 2xctD-1krhA:
3.0		 2xctD-1krhA:
18.83
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.
3B0W_B_DGXB1_1
(NUCLEAR RECEPTOR
ROR-GAMMA)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		5 / 12 GLN A 230
LEU A 259
ALA A 255
VAL A 254
LEU A 185
 None
 1.09A 3b0wB-1krhA:
undetectable		 3b0wB-1krhA:
21.43
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.
3BOG_C_DVAC59_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		3 / 3 GLY A 221
GLY A 246
GLY A 219
 None
None
SO4  A 402 (-3.5A)
 0.37A 3bogC-1krhA:
undetectable		 3bogC-1krhA:
12.13
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.
3H5G_C_LEIC16_0
(COIL SER L16D-PEN)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		4 / 6 LEU A 266
GLN A 230
LEU A 232
GLU A 233
 None
 1.02A 3h5gB-1krhA:
undetectable
3h5gC-1krhA:
undetectable		 3h5gB-1krhA:
7.67
3h5gC-1krhA:
7.67
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.
3KO0_F_TFPF201_1
(PROTEIN S100-A4)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		4 / 5 PHE A 139
PHE A 160
PHE A 109
PHE A 197
 None
 1.46A 3ko0F-1krhA:
undetectable
3ko0G-1krhA:
undetectable		 3ko0F-1krhA:
13.41
3ko0G-1krhA:
13.41
Potential target for repurposing, i.e. matched protein structure has less than 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)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		5 / 7 PHE A 171
PHE A 197
GLY A 111
ILE A 137
PHE A 160
 None
 1.43A 4ejjA-1krhA:
undetectable		 4ejjA-1krhA:
22.78
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.
4FGJ_A_1PQA304_0
(RIBOSYLDIHYDRONICOTI
NAMIDE DEHYDROGENASE
[QUINONE])		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		4 / 8 ILE A 137
PHE A 171
GLY A 111
GLU A 110
 None
 0.97A 4fgjA-1krhA:
2.9
4fgjB-1krhA:
2.8		 4fgjA-1krhA:
20.81
4fgjB-1krhA:
20.81
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K37_A_SAMA504_0
(ANAEROBIC
SULFATASE-MATURATING
ENZYME)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		5 / 11 TYR A 271
GLU A 233
GLN A 258
LEU A 226
ILE A 222
 None
 1.47A 4k37A-1krhA:
undetectable		 4k37A-1krhA:
18.91
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.
4K37_B_SAMB504_0
(ANAEROBIC
SULFATASE-MATURATING
ENZYME)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		5 / 11 TYR A 271
GLU A 233
GLN A 258
LEU A 226
ILE A 222
 None
 1.48A 4k37B-1krhA:
0.5		 4k37B-1krhA:
18.91
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.
4K38_A_SAMA504_0
(ANAEROBIC
SULFATASE-MATURATING
ENZYME
KP18CYS PEPTIDE)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		5 / 12 TYR A 271
GLU A 233
GLN A 258
LEU A 226
ILE A 222
 None
 1.34A 4k38A-1krhA:
1.5
4k38D-1krhA:
undetectable		 4k38A-1krhA:
18.91
4k38D-1krhA:
4.44
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4K38_B_SAMB504_0
(ANAEROBIC
SULFATASE-MATURATING
ENZYME)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		5 / 12 TYR A 271
GLU A 233
GLN A 258
LEU A 226
ILE A 222
 None
 1.30A 4k38B-1krhA:
0.8		 4k38B-1krhA:
18.91
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.
4K39_A_SAMA504_0
(ANAEROBIC
SULFATASE-MATURATING
ENZYME)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		5 / 12 TYR A 271
GLU A 233
GLN A 258
LEU A 226
ILE A 222
 None
 1.23A 4k39A-1krhA:
undetectable		 4k39A-1krhA:
18.91
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.
4P6X_G_HCYG900_2
(GLUCOCORTICOID
RECEPTOR)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		3 / 3 LEU A  26
MET A  39
TYR A  79
 None
FES  A 500 (-3.8A)
None
 0.66A 4p6xG-1krhA:
undetectable		 4p6xG-1krhA:
18.95
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4PFJ_B_ADNB502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		4 / 6 THR A 169
GLN A 129
THR A 198
HIS A 108
 None
 1.28A 4pfjB-1krhA:
3.7		 4pfjB-1krhA:
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.
5AXA_A_ADNA502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		4 / 5 THR A  48
THR A 104
HIS A 138
LEU A 140
 None
 1.30A 5axaA-1krhA:
4.0		 5axaA-1krhA:
20.99
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.
5AXA_C_ADNC502_2
(ADENOSYLHOMOCYSTEINA
SE)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		4 / 5 THR A  48
THR A 104
HIS A 138
LEU A 140
 None
 1.30A 5axaC-1krhA:
3.7		 5axaC-1krhA:
20.99
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.
5KIR_A_RCXA601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		5 / 12 VAL A 241
TYR A 305
ALA A 328
SER A 237
LEU A 232
 None
 1.08A 5kirA-1krhA:
0.0		 5kirA-1krhA:
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.
5KIR_B_RCXB601_1
(PROSTAGLANDIN G/H
SYNTHASE 2)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		5 / 12 VAL A 241
TYR A 305
ALA A 328
SER A 237
LEU A 232
 None
 1.08A 5kirB-1krhA:
undetectable		 5kirB-1krhA:
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.
5UTU_H_ADNH503_2
(ADENOSYLHOMOCYSTEINA
SE)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		4 / 5 THR A  48
THR A 104
HIS A 138
LEU A 140
 None
 1.29A 5utuH-1krhA:
3.1		 5utuH-1krhA:
20.68
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VW4_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		7 / 9 SER A 159
THR A 220
GLY A 221
ALA A 223
CYH A 307
GLY A 308
GLU A 333
 FAD  A 501 (-3.1A)
FAD  A 501 (-3.2A)
None
FAD  A 501 ( 3.7A)
None
None
FAD  A 501 (-3.6A)
 0.63A 5vw4A-1krhA:
23.4		 5vw4A-1krhA:
25.00
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.
5VW5_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		6 / 8 SER A 159
THR A 220
GLY A 221
CYH A 307
GLY A 308
GLU A 333
 FAD  A 501 (-3.1A)
FAD  A 501 (-3.2A)
None
None
None
FAD  A 501 (-3.6A)
 0.68A 5vw5A-1krhA:
23.4		 5vw5A-1krhA:
25.07
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.
5VW9_A_NCAA403_0
(FERREDOXIN--NADP
REDUCTASE)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		7 / 8 SER A 159
THR A 220
GLY A 221
ALA A 223
CYH A 307
GLY A 308
GLU A 333
 FAD  A 501 (-3.1A)
FAD  A 501 (-3.2A)
None
FAD  A 501 ( 3.7A)
None
None
FAD  A 501 (-3.6A)
 0.65A 5vw9A-1krhA:
23.1		 5vw9A-1krhA:
25.00
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.
5ZCP_J_CHDJ101_0
(CYTOCHROME C OXIDASE
SUBUNIT 1
CYTOCHROME C OXIDASE
SUBUNIT 7A1,
MITOCHONDRIAL)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		4 / 7 ILE A 325
LEU A 297
ARG A 317
LEU A 216
 None
 0.92A 5zcpA-1krhA:
0.0
5zcpJ-1krhA:
undetectable		 5zcpA-1krhA:
19.89
5zcpJ-1krhA:
8.62
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.
6BZO_C_FI8C1201_2
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
RNA POLYMERASE SIGMA
FACTOR SIGA)		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		4 / 4 LEU A 259
ASP A 260
GLN A 263
VAL A 313
 None
 1.31A 6bzoF-1krhA:
undetectable		 6bzoF-1krhA:
18.91
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.
6C06_D_FI8D1404_0
(DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA
DNA-DIRECTED RNA
POLYMERASE SUBUNIT
BETA')		 1krh BENZOATE
1,2-DIOXYGENASE
REDUCTASE
(Acinetobacter
sp.) 		4 / 8 ILE A 222
THR A 220
THR A 125
SER A 120
 None
FAD  A 501 (-3.2A)
None
None
 1.09A 6c06C-1krhA:
undetectable		 6c06C-1krhA:
undetectable