SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'AI9'


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.
2BDM_A_TMIA501_1
(CYTOCHROME P450 2B4)		 4g3m RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBD
(Bacillus
subtilis) 		4 / 7 SER A 188
LEU A 190
GLY A 291
ILE A 326
 None
None
AI9  A 402 ( 4.0A)
None
 1.10A 2bdmA-4g3mA:
undetectable		 2bdmA-4g3mA:
22.31
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.
2WD9_A_IBPA1570_1
(ACYL-COENZYME A
SYNTHETASE ACSM2A,
MITOCHONDRIAL)		 4g3m RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBD
(Bacillus
subtilis) 		4 / 7 ILE A 218
LEU A 219
VAL A 295
GLY A 291
 None
None
None
AI9  A 402 ( 4.0A)
 0.67A 2wd9A-4g3mA:
3.1		 2wd9A-4g3mA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
2WD9_B_IBPB1570_1
(ACYL-COENZYME A
SYNTHETASE ACSM2A,
MITOCHONDRIAL)		 4g3m RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBD
(Bacillus
subtilis) 		4 / 8 ILE A 218
LEU A 219
VAL A 295
GLY A 291
 None
None
None
AI9  A 402 ( 4.0A)
 0.68A 2wd9B-4g3mA:
undetectable		 2wd9B-4g3mA:
22.03
Potential target for repurposing, i.e. matched protein structure has less than 30% sequence identity to known drug target, and may potentially interact with the same drug molecule based on local structural similarity of binding site.
3TWP_A_SALA404_1
(ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE)		 4g3m RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBD
(Bacillus
subtilis) 		4 / 7 ALA A 152
TYR A 311
ARG A 176
ALA A 179
 None
None
None
AI9  A 402 ( 4.7A)
 0.95A 3twpA-4g3mA:
undetectable		 3twpA-4g3mA:
21.36
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.
3TWP_B_SALB404_1
(ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE)		 4g3m RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBD
(Bacillus
subtilis) 		4 / 7 ALA A 152
TYR A 311
ARG A 176
ALA A 179
 None
None
None
AI9  A 402 ( 4.7A)
 1.00A 3twpB-4g3mA:
undetectable		 3twpB-4g3mA:
21.36
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.
3TWP_C_SALC404_1
(ANTHRANILATE
PHOSPHORIBOSYLTRANSF
ERASE)		 4g3m RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBD
(Bacillus
subtilis) 		4 / 7 ALA A 152
TYR A 311
ARG A 176
ALA A 179
 None
None
None
AI9  A 402 ( 4.7A)
 1.13A 3twpC-4g3mA:
undetectable		 3twpC-4g3mA:
21.36
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.
5ZOV_B_ASCB501_0
(PTS
ASCORBATE-SPECIFIC
SUBUNIT IIBC)		 4g3m RIBOFLAVIN
BIOSYNTHESIS PROTEIN
RIBD
(Bacillus
subtilis) 		5 / 12 PRO A 214
ILE A 236
GLN A 213
ARG A 206
ILE A 189
 None
None
None
AI9  A 402 (-2.8A)
None
 1.19A 5zovB-4g3mA:
undetectable		 5zovB-4g3mA:
22.13