SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'IAP'

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 (%)
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	1KVL_A_CLSA371_1 (BETA-LACTAMASE)	1s6r	BETA-LACTAMASE (Enterobacter cloacae)	8 / 10	LEU A 119 GLN A 120 TYR A 150 ASN A 152 TYR A 221 LYS A 315 THR A 316 GLY A 317	None IAP A 1 (-2.8A) None IAP A 1 (-2.9A) IAP A 1 ( 3.9A) IAP A 1 ( 4.9A) None IAP A 1 (-3.8A)	0.60A	1kvlA-1s6rA: 59.9	1kvlA-1s6rA: 69.64
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.	3HUO_A_PNNA300_0 (CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE)	1s6r	BETA-LACTAMASE (Enterobacter cloacae)	5 / 12	LYS A 67 ASN A 152 LYS A 315 THR A 316 GLY A 317	IAP A 1 ( 4.0A) IAP A 1 (-2.9A) IAP A 1 ( 4.9A) None IAP A 1 (-3.8A)	0.67A	3huoA-1s6rA: 14.1	3huoA-1s6rA: 23.95
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.	3MZE_A_CFXA364_1 (D-ALANYL-D-ALANINE CARBOXYPEPTIDASE DACA)	1s6r	BETA-LACTAMASE (Enterobacter cloacae)	7 / 12	SER A 64 LYS A 67 ASN A 152 THR A 316 GLY A 317 THR A 319 ARG A 349	IAP A 1 (-1.4A) IAP A 1 ( 4.0A) IAP A 1 (-2.9A) None IAP A 1 (-3.8A) None None	0.94A	3mzeA-1s6rA: 14.1	3mzeA-1s6rA: 23.76
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.	4PCL_A_SAMA301_1 (O-METHYLTRANSFERASE FAMILY PROTEIN)	1s6r	BETA-LACTAMASE (Enterobacter cloacae)	4 / 5	SER A 264 GLU A 272 LYS A 315 ASN A 346	None None IAP A 1 ( 4.9A) None	1.43A	4pclA-1s6rA: undetectable	4pclA-1s6rA: 22.87

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1KVL_A_CLSA371_1","BETA-LACTAMASE","1s6r","BETA-LACTAMASE","Enterobacter cloacae",8,"LEU A 119;GLN A 120;TYR A 150;ASN A 152;TYR A 221;LYS A 315;THR A 316;GLY A 317","None;IAP A   1 (-2.8A);None;IAP A   1 (-2.9A);IAP A   1 ( 3.9A);IAP A   1 ( 4.9A);None;IAP A   1 (-3.8A)","0.60A","1kvlA-1s6rA:59.9",null],["3HUO_A_PNNA300_0","CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE","1s6r","BETA-LACTAMASE","Enterobacter cloacae",5,"LYS A  67;ASN A 152;LYS A 315;THR A 316;GLY A 317","IAP A   1 ( 4.0A);IAP A   1 (-2.9A);IAP A   1 ( 4.9A);None;IAP A   1 (-3.8A)","0.67A","3huoA-1s6rA:14.1","1kvlA-1s6rA:69.64"],["3MZE_A_CFXA364_1","D-ALANYL-D-ALANINE CARBOXYPEPTIDASE DACA","1s6r","BETA-LACTAMASE","Enterobacter cloacae",7,"SER A  64;LYS A  67;ASN A 152;THR A 316;GLY A 317;THR A 319;ARG A 349","IAP A   1 (-1.4A);IAP A   1 ( 4.0A);IAP A   1 (-2.9A);None;IAP A   1 (-3.8A);None;None","0.94A","3mzeA-1s6rA:14.1","3huoA-1s6rA:23.95"],["4PCL_A_SAMA301_1","O-METHYLTRANSFERASE FAMILY PROTEIN","1s6r","BETA-LACTAMASE","Enterobacter cloacae",4,"SER A 264;GLU A 272;LYS A 315;ASN A 346","None;None;IAP A   1 ( 4.9A);None","1.43A","4pclA-1s6rA:undetectable","3mzeA-1s6rA:23.76"]]