SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1nbu'

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.	2JFA_B_CCSB417_0 (ESTROGEN RECEPTOR)	1nbu	PROBABLE DIHYDRONEOPTERIN ALDOLASE (Mycobacterium tuberculosis)	3 / 3	GLN B 101 LYS B 99 VAL B 30	None PH2 B 320 (-3.1A) None	0.80A	2jfaB-1nbuB: 0.0	2jfaB-1nbuB: 17.32
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_PNNA303_0 (CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE)	1nbu	PROBABLE DIHYDRONEOPTERIN ALDOLASE (Mycobacterium tuberculosis)	4 / 4	GLN B 101 GLN B 27 GLY B 14 HIS B 16	None	1.25A	3huoA-1nbuB: 0.0	3huoA-1nbuB: 20.45
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.	4IAQ_A_2GMA2001_2 (CHIMERA PROTEIN OF HUMAN 5-HYDROXYTRYPTAMINE RECEPTOR 1B AND E. COLI SOLUBLE CYTOCHROME B562)	1nbu	PROBABLE DIHYDRONEOPTERIN ALDOLASE (Mycobacterium tuberculosis)	4 / 6	ILE B 5 THR B 51 VAL B 95 ASP B 82	None	1.08A	4iaqA-1nbuB: undetectable	4iaqA-1nbuB: 14.46
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.	4OJ4_A_DIFA501_1 (PEROXISOME PROLIFERATOR-ACTIVAT ED RECEPTOR GAMMA)	1nbu	PROBABLE DIHYDRONEOPTERIN ALDOLASE (Mycobacterium tuberculosis)	4 / 8	LEU B 57 LEU B 7 VAL B 33 ILE B 31	None	0.88A	4oj4A-1nbuB: 0.0	4oj4A-1nbuB: 18.94

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2JFA_B_CCSB417_0","ESTROGEN RECEPTOR","1nbu","PROBABLE DIHYDRONEOPTERIN ALDOLASE","Mycobacterium tuberculosis",3,"GLN B 101;LYS B  99;VAL B  30","None;PH2 B 320 (-3.1A);None","0.80A","2jfaB-1nbuB:0.0","2jfaB-1nbuB:17.32"],["3HUO_A_PNNA303_0","CTX-M-9 EXTENDED-SPECTRUM BETA-LACTAMASE","1nbu","PROBABLE DIHYDRONEOPTERIN ALDOLASE","Mycobacterium tuberculosis",4,"GLN B 101;GLN B  27;GLY B  14;HIS B  16","None","1.25A","3huoA-1nbuB:0.0","3huoA-1nbuB:20.45"],["4IAQ_A_2GMA2001_2","CHIMERA PROTEIN OF HUMAN 5-HYDROXYTRYPTAMINE RECEPTOR 1B AND E. COLI SOLUBLE CYTOCHROME B562","1nbu","PROBABLE DIHYDRONEOPTERIN ALDOLASE","Mycobacterium tuberculosis",4,"ILE B   5;THR B  51;VAL B  95;ASP B  82","None","1.08A","4iaqA-1nbuB:undetectable","4iaqA-1nbuB:14.46"],["4OJ4_A_DIFA501_1","PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR GAMMA","1nbu","PROBABLE DIHYDRONEOPTERIN ALDOLASE","Mycobacterium tuberculosis",4,"LEU B  57;LEU B   7;VAL B  33;ILE B  31","None","0.88A","4oj4A-1nbuB:0.0","4oj4A-1nbuB:18.94"]]