SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4usq'

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.
1NW5_A_SAMA401_0
(MODIFICATION
METHYLASE RSRI)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		5 / 12 TRP A 275
THR A 290
GLY A 184
SER A 183
ALA A 261
 None
None
None
FAD  A1361 (-3.2A)
None
 1.28A 1nw5A-4usqA:
undetectable		 1nw5A-4usqA:
20.83
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.
2HJH_B_NCAB901_0
(NAD-DEPENDENT
HISTONE DEACETYLASE
SIR2)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		4 / 5 ILE A 145
PRO A 146
PHE A 268
VAL A 178
 None
 1.20A 2hjhB-4usqA:
undetectable		 2hjhB-4usqA:
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.
2QEI_A_CXXA802_1
(TRANSPORTER)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		4 / 6 SER A  35
PHE A  39
ILE A  18
PHE A 101
 None
 1.26A 2qeiA-4usqA:
undetectable		 2qeiA-4usqA:
20.83
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.
3BGD_A_PM6A301_1
(THIOPURINE
S-METHYLTRANSFERASE)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		4 / 6 PHE A 292
GLY A 138
ALA A 295
PRO A 294
 FAD  A1361 ( 4.7A)
FAD  A1361 (-3.3A)
None
None
 0.94A 3bgdA-4usqA:
undetectable		 3bgdA-4usqA:
22.04
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.
3ETE_C_H3PC552_1
(GLUTAMATE
DEHYDROGENASE)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		3 / 3 TYR A  99
TYR A  91
GLY A  72
 None
 0.74A 3eteB-4usqA:
undetectable
3eteD-4usqA:
2.3
3eteF-4usqA:
2.4		 3eteB-4usqA:
22.40
3eteD-4usqA:
22.40
3eteF-4usqA:
22.40
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3SUD_A_SUEA1201_2
(NS3 PROTEASE, NS4A
PROTEIN)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		4 / 4 PHE A 101
TYR A  91
ILE A  19
LEU A  42
 None
 1.45A 3sudA-4usqA:
undetectable		 3sudA-4usqA:
20.71
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.
3TZF_B_08DB280_1
(7,8-DIHYDROPTEROATE
SYNTHASE)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		4 / 8 THR A 222
GLY A 342
PHE A 218
SER A 346
 None
 1.05A 3tzfB-4usqA:
undetectable		 3tzfB-4usqA:
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.
3U88_A_CHDA611_0
(MENIN)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		3 / 3 SER A 183
PHE A  62
LYS A 243
 FAD  A1361 (-3.2A)
FAD  A1361 (-3.3A)
None
 0.95A 3u88A-4usqA:
undetectable		 3u88A-4usqA:
21.21
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.
4E3H_A_HQEA303_1
(CARBONIC ANHYDRASE 2)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		5 / 10 VAL A 200
LEU A 176
VAL A 178
VAL A 286
TRP A 288
 None
 0.89A 4e3hA-4usqA:
undetectable		 4e3hA-4usqA:
18.90
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.
4J26_B_ESTB600_1
(ESTROGEN RECEPTOR
BETA)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		5 / 12 GLU A  96
LEU A  26
ARG A 105
ILE A  16
ILE A 134
 None
 1.13A 4j26B-4usqA:
undetectable		 4j26B-4usqA:
22.16
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.
4LTW_A_486A302_1
(ANCESTRAL STEROID
RECEPTOR 2)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		5 / 12 LEU A  32
VAL A  28
ILE A  18
ILE A  16
ALA A 130
 None
 0.99A 4ltwA-4usqA:
undetectable		 4ltwA-4usqA:
18.38
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MA8_C_Z80C301_1
(MAJOR PRION PROTEIN)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		4 / 5 LEU A  59
GLY A  55
ILE A 187
GLN A 186
 None
 1.21A 4ma8C-4usqA:
undetectable		 4ma8C-4usqA:
16.05
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.
4MM5_A_SREA603_1
(TRANSPORTER)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		5 / 9 VAL A 286
ALA A 285
GLY A 150
PHE A 268
GLY A 156
 None
 1.13A 4mm5A-4usqA:
undetectable		 4mm5A-4usqA:
20.45
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
4MMF_A_29QA603_1
(TRANSPORTER)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		5 / 9 VAL A 286
ALA A 285
GLY A 150
PHE A 268
GLY A 156
 None
 1.25A 4mmfA-4usqA:
undetectable		 4mmfA-4usqA:
21.27
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.
4MMF_B_29QB603_1
(TRANSPORTER)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		5 / 9 VAL A 286
ALA A 285
GLY A 150
PHE A 268
GLY A 156
 None
 1.26A 4mmfB-4usqA:
undetectable		 4mmfB-4usqA:
21.27
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.
5A7M_A_ACTA1923_0
(BETA-XYLOSIDASE)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		3 / 3 ASP A  15
ARG A 131
TYR A  37
 None
 0.66A 5a7mA-4usqA:
2.5		 5a7mA-4usqA:
19.48
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.
5A7M_B_ACTB1924_0
(BETA-XYLOSIDASE)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		3 / 3 ASP A  15
ARG A 131
TYR A  37
 None
 0.64A 5a7mB-4usqA:
2.7		 5a7mB-4usqA:
19.48
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.
5E26_A_PAUA602_0
(PANTOTHENATE KINASE
2, MITOCHONDRIAL)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		4 / 7 GLY A 328
SER A 346
GLY A 344
ALA A 338
 FAD  A1361 (-4.2A)
None
None
None
 0.99A 5e26A-4usqA:
undetectable
5e26B-4usqA:
undetectable		 5e26A-4usqA:
19.95
5e26B-4usqA:
19.95
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.
5TT3_B_EZLB303_1
(ALPHA-CARBONIC
ANHYDRASE)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		5 / 9 HIS A 298
VAL A 121
VAL A 109
THR A 137
ALA A 136
 FAD  A1361 ( 4.6A)
None
FAD  A1361 (-3.6A)
FAD  A1361 (-3.9A)
None
 1.22A 5tt3B-4usqA:
undetectable		 5tt3B-4usqA:
21.53
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5UIH_A_8CVA201_1
(DIHYDROFOLATE
REDUCTASE)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		4 / 8 ILE A  16
ALA A 130
LEU A 324
ILE A  18
 None
 0.90A 5uihA-4usqA:
undetectable		 5uihA-4usqA:
13.71
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5VCG_A_08YA602_1
(CYTOCHROME P450 3A4)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		5 / 12 PHE A 218
ILE A 341
ALA A 347
THR A 350
GLU A 331
 None
 1.09A 5vcgA-4usqA:
undetectable		 5vcgA-4usqA:
20.55
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
5WM2_A_ACTA605_0
(SALICYLATE-AMP
LIGASE)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		3 / 3 THR A  78
THR A  81
ARG A  60
 None
 1.04A 5wm2A-4usqA:
undetectable		 5wm2A-4usqA:
21.78
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.
5XIW_D_LOCD503_2
(TUBULIN BETA CHAIN)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		5 / 12 LEU A 327
ALA A 347
ILE A  18
ALA A 136
ILE A  16
 None
 1.15A 5xiwD-4usqA:
undetectable		 5xiwD-4usqA:
13.02
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.
6DHB_A_BEZA202_0
(HEPATITIS A VIRUS
CELLULAR RECEPTOR 2)		 4usq PYRIDINE
NUCLEOTIDE-DISULFIDE
OXIDOREDUCTASE
(Cellvibrio
sp.
BR) 		4 / 6 ARG A 105
ILE A  18
MET A  41
ASP A  43
 None
None
None
FAD  A1361 (-2.7A)
 1.47A 6dhbA-4usqA:
undetectable		 6dhbA-4usqA:
13.02