SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2bkj'

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.	2QD3_A_CHDA501_0 (FERROCHELATASE)	2bkj	FLAVIN REDUCTASE (Vibrio harveyi)	5 / 11	LEU A 77 LEU A 157 LEU A 124 ARG A 50 ILE A 48	None	1.30A	2qd3A-2bkjA: undetectable	2qd3A-2bkjA: 21.10
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.	2VH3_B_DAHB2_1 (RANASMURFIN)	2bkj	FLAVIN REDUCTASE (Vibrio harveyi)	4 / 8	ALA A 68 GLY A 126 SER A 72 ALA A 73	None	0.87A	2vh3B-2bkjA: undetectable	2vh3B-2bkjA: 19.64
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.	3ROX_A_TEPA266_1 (APOLIPOPROTEIN A-I-BINDING PROTEIN)	2bkj	FLAVIN REDUCTASE (Vibrio harveyi)	5 / 8	ALA A 136 VAL A 139 ASP A 140 LEU A 143 LEU A 152	None	0.85A	3roxA-2bkjA: undetectable	3roxA-2bkjA: 21.86
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.	4NKV_A_AERA601_1 (STEROID 17-ALPHA-HYDROXYLASE /17,20 LYASE)	2bkj	FLAVIN REDUCTASE (Vibrio harveyi)	5 / 12	LEU A 77 ALA A 119 ILE A 48 GLY A 34 ALA A 33	None	1.06A	4nkvA-2bkjA: undetectable	4nkvA-2bkjA: 18.37
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.	4NKV_C_AERC601_1 (STEROID 17-ALPHA-HYDROXYLASE /17,20 LYASE)	2bkj	FLAVIN REDUCTASE (Vibrio harveyi)	5 / 12	LEU A 77 ALA A 119 ILE A 48 GLY A 34 ALA A 33	None	1.04A	4nkvC-2bkjA: undetectable	4nkvC-2bkjA: 18.37
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.	4NKV_D_AERD601_1 (STEROID 17-ALPHA-HYDROXYLASE /17,20 LYASE)	2bkj	FLAVIN REDUCTASE (Vibrio harveyi)	5 / 12	LEU A 77 ALA A 119 ILE A 48 GLY A 34 ALA A 33	None	1.04A	4nkvD-2bkjA: undetectable	4nkvD-2bkjA: 18.37

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2QD3_A_CHDA501_0","FERROCHELATASE","2bkj","FLAVIN REDUCTASE","Vibrio harveyi",5,"LEU A  77;LEU A 157;LEU A 124;ARG A  50;ILE A  48","None","1.30A","2qd3A-2bkjA:undetectable","2qd3A-2bkjA:21.10"],["2VH3_B_DAHB2_1","RANASMURFIN","2bkj","FLAVIN REDUCTASE","Vibrio harveyi",4,"ALA A  68;GLY A 126;SER A  72;ALA A  73","None","0.87A","2vh3B-2bkjA:undetectable","2vh3B-2bkjA:19.64"],["3ROX_A_TEPA266_1","APOLIPOPROTEIN A-I-BINDING PROTEIN","2bkj","FLAVIN REDUCTASE","Vibrio harveyi",5,"ALA A 136;VAL A 139;ASP A 140;LEU A 143;LEU A 152","None","0.85A","3roxA-2bkjA:undetectable","3roxA-2bkjA:21.86"],["4NKV_A_AERA601_1","STEROID 17-ALPHA-HYDROXYLASE\/17,20 LYASE","2bkj","FLAVIN REDUCTASE","Vibrio harveyi",5,"LEU A  77;ALA A 119;ILE A  48;GLY A  34;ALA A  33","None","1.06A","4nkvA-2bkjA:undetectable","4nkvA-2bkjA:18.37"],["4NKV_C_AERC601_1","STEROID 17-ALPHA-HYDROXYLASE\/17,20 LYASE","2bkj","FLAVIN REDUCTASE","Vibrio harveyi",5,"LEU A  77;ALA A 119;ILE A  48;GLY A  34;ALA A  33","None","1.04A","4nkvC-2bkjA:undetectable","4nkvC-2bkjA:18.37"],["4NKV_D_AERD601_1","STEROID 17-ALPHA-HYDROXYLASE\/17,20 LYASE","2bkj","FLAVIN REDUCTASE","Vibrio harveyi",5,"LEU A  77;ALA A 119;ILE A  48;GLY A  34;ALA A  33","None","1.04A","4nkvD-2bkjA:undetectable","4nkvD-2bkjA:18.37"]]