SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'MHI'

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 (%)
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.	1NX9_A_AICA5001_1 (ALPHA-AMINO ACID ESTER HYDROLASE)	3o9p	PERIPLASMIC MUREIN PEPTIDE-BINDING PROTEIN (Escherichia coli)	4 / 8	ARG A 402 GLN A 393 HIS A 369 TYR A 272	MHI A 516 (-2.8A) None None None	1.33A	1nx9A-3o9pA: undetectable	1nx9A-3o9pA: 21.66
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.	1NX9_B_AICB5002_1 (ALPHA-AMINO ACID ESTER HYDROLASE)	3o9p	PERIPLASMIC MUREIN PEPTIDE-BINDING PROTEIN (Escherichia coli)	4 / 8	ARG A 402 GLN A 393 HIS A 369 TYR A 272	MHI A 516 (-2.8A) None None None	1.30A	1nx9B-3o9pA: undetectable	1nx9B-3o9pA: 21.66
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.	1NX9_C_AICC5003_1 (ALPHA-AMINO ACID ESTER HYDROLASE)	3o9p	PERIPLASMIC MUREIN PEPTIDE-BINDING PROTEIN (Escherichia coli)	4 / 8	ARG A 402 GLN A 393 HIS A 369 TYR A 272	MHI A 516 (-2.8A) None None None	1.30A	1nx9C-3o9pA: undetectable	1nx9C-3o9pA: 21.66
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.	1NX9_D_AICD5004_1 (ALPHA-AMINO ACID ESTER HYDROLASE)	3o9p	PERIPLASMIC MUREIN PEPTIDE-BINDING PROTEIN (Escherichia coli)	4 / 8	ARG A 402 GLN A 393 HIS A 369 TYR A 272	MHI A 516 (-2.8A) None None None	1.31A	1nx9D-3o9pA: undetectable	1nx9D-3o9pA: 21.66
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.	5FSA_A_X2NA590_1 (CYP51 VARIANT1)	3o9p	PERIPLASMIC MUREIN PEPTIDE-BINDING PROTEIN (Escherichia coli)	5 / 12	PHE A 424 PHE A 109 GLY A 269 LEU A 34 PHE A 162	None None None MHI A 516 (-3.7A) None	1.13A	5fsaA-3o9pA: undetectable	5fsaA-3o9pA: 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.	5V5Z_A_1YNA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	3o9p	PERIPLASMIC MUREIN PEPTIDE-BINDING PROTEIN (Escherichia coli)	5 / 12	PHE A 424 PHE A 109 GLY A 269 LEU A 34 PHE A 162	None None None MHI A 516 (-3.7A) None	1.13A	5v5zA-3o9pA: undetectable	5v5zA-3o9pA: 21.74

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1NX9_A_AICA5001_1","ALPHA-AMINO ACID ESTER HYDROLASE","3o9p","PERIPLASMIC MUREIN PEPTIDE-BINDING PROTEIN","Escherichia coli",4,"ARG A 402;GLN A 393;HIS A 369;TYR A 272","MHI A 516 (-2.8A);None;None;None","1.33A","1nx9A-3o9pA:undetectable",null],["1NX9_B_AICB5002_1","ALPHA-AMINO ACID ESTER HYDROLASE","3o9p","PERIPLASMIC MUREIN PEPTIDE-BINDING PROTEIN","Escherichia coli",4,"ARG A 402;GLN A 393;HIS A 369;TYR A 272","MHI A 516 (-2.8A);None;None;None","1.30A","1nx9B-3o9pA:undetectable","1nx9A-3o9pA:21.66"],["1NX9_C_AICC5003_1","ALPHA-AMINO ACID ESTER HYDROLASE","3o9p","PERIPLASMIC MUREIN PEPTIDE-BINDING PROTEIN","Escherichia coli",4,"ARG A 402;GLN A 393;HIS A 369;TYR A 272","MHI A 516 (-2.8A);None;None;None","1.30A","1nx9C-3o9pA:undetectable","1nx9B-3o9pA:21.66"],["1NX9_D_AICD5004_1","ALPHA-AMINO ACID ESTER HYDROLASE","3o9p","PERIPLASMIC MUREIN PEPTIDE-BINDING PROTEIN","Escherichia coli",4,"ARG A 402;GLN A 393;HIS A 369;TYR A 272","MHI A 516 (-2.8A);None;None;None","1.31A","1nx9D-3o9pA:undetectable","1nx9C-3o9pA:21.66"],["5FSA_A_X2NA590_1","CYP51 VARIANT1","3o9p","PERIPLASMIC MUREIN PEPTIDE-BINDING PROTEIN","Escherichia coli",5,"PHE A 424;PHE A 109;GLY A 269;LEU A  34;PHE A 162","None;None;None;MHI A 516 (-3.7A);None","1.13A","5fsaA-3o9pA:undetectable","1nx9D-3o9pA:21.66"],["5V5Z_A_1YNA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","3o9p","PERIPLASMIC MUREIN PEPTIDE-BINDING PROTEIN","Escherichia coli",5,"PHE A 424;PHE A 109;GLY A 269;LEU A  34;PHE A 162","None;None;None;MHI A 516 (-3.7A);None","1.13A","5v5zA-3o9pA:undetectable","5fsaA-3o9pA:21.02"]]