SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3hcg'

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.	2Y7K_B_SALB1305_1 (LYSR-TYPE REGULATORY PROTEIN)	3hcg	PEPTIDE METHIONINE SULFOXIDE REDUCTASE MSRA/MSRB (Neisseria meningitidis)	4 / 5	SER A 444 ARG A 493 PRO A 486 GLY A 485	None	1.38A	2y7kB-3hcgA: undetectable	2y7kB-3hcgA: 19.72
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.	5ESG_A_1YNA701_2 (LANOSTEROL 14-ALPHA DEMETHYLASE)	3hcg	PEPTIDE METHIONINE SULFOXIDE REDUCTASE MSRA/MSRB (Neisseria meningitidis)	4 / 4	LEU A 478 TYR A 436 PRO A 448 ILE A 449	None	1.41A	5esgA-3hcgA: undetectable	5esgA-3hcgA: 12.36
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.	5ESG_A_1YNA701_2 (LANOSTEROL 14-ALPHA DEMETHYLASE)	3hcg	PEPTIDE METHIONINE SULFOXIDE REDUCTASE MSRA/MSRB (Neisseria meningitidis)	4 / 4	LEU A 501 TYR A 378 PRO A 428 ILE A 449	None	1.42A	5esgA-3hcgA: undetectable	5esgA-3hcgA: 12.36
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.	5ESG_A_1YNA701_2 (LANOSTEROL 14-ALPHA DEMETHYLASE)	3hcg	PEPTIDE METHIONINE SULFOXIDE REDUCTASE MSRA/MSRB (Neisseria meningitidis)	4 / 4	LEU A 501 TYR A 436 PRO A 448 ILE A 449	None	1.14A	5esgA-3hcgA: undetectable	5esgA-3hcgA: 12.36

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2Y7K_B_SALB1305_1","LYSR-TYPE REGULATORY PROTEIN","3hcg","PEPTIDE METHIONINE SULFOXIDE REDUCTASE MSRA\/MSRB","Neisseria meningitidis",4,"SER A 444;ARG A 493;PRO A 486;GLY A 485","None","1.38A","2y7kB-3hcgA:undetectable","2y7kB-3hcgA:19.72"],["5ESG_A_1YNA701_2","LANOSTEROL 14-ALPHA DEMETHYLASE","3hcg","PEPTIDE METHIONINE SULFOXIDE REDUCTASE MSRA\/MSRB","Neisseria meningitidis",4,"LEU A 478;TYR A 436;PRO A 448;ILE A 449","None","1.41A","5esgA-3hcgA:undetectable","5esgA-3hcgA:12.36"],["5ESG_A_1YNA701_2","LANOSTEROL 14-ALPHA DEMETHYLASE","3hcg","PEPTIDE METHIONINE SULFOXIDE REDUCTASE MSRA\/MSRB","Neisseria meningitidis",4,"LEU A 501;TYR A 378;PRO A 428;ILE A 449","None","1.42A","5esgA-3hcgA:undetectable","5esgA-3hcgA:12.36"],["5ESG_A_1YNA701_2","LANOSTEROL 14-ALPHA DEMETHYLASE","3hcg","PEPTIDE METHIONINE SULFOXIDE REDUCTASE MSRA\/MSRB","Neisseria meningitidis",4,"LEU A 501;TYR A 436;PRO A 448;ILE A 449","None","1.14A","5esgA-3hcgA:undetectable","5esgA-3hcgA:12.36"]]