SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'I3P'

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.	1P93_D_DEXD4999_2 (GLUCOCORTICOID RECEPTOR)	2p0d	RHO GTPASE-ACTIVATING PROTEIN 9 (Homo sapiens)	4 / 5	LEU A 403 TRP A 345 MET A 331 LEU A 329	None I3P A 800 (-4.1A) None None	1.35A	1p93D-2p0dA: undetectable	1p93D-2p0dA: 19.42
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.	3AQI_A_CHDA3_0 (FERROCHELATASE)	1n4k	INOSITOL 1,4,5-TRISPHOSPHATE RECEPTOR TYPE 1 (Mus musculus)	3 / 3	PRO A 405 LEU A 416 ARG A 265	None None I3P A1000 (-3.0A)	0.89A	3aqiA-1n4kA: undetectable	3aqiA-1n4kA: 22.88
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.	3EEO_A_SAMA328_1 (MODIFICATION METHYLASE HHAI)	3c5n	TUBBY-RELATED PROTEIN 1 (Homo sapiens)	3 / 3	GLU A 458 SER A 434 VAL A 435	I3P A 2 ( 4.7A) I3P A 2 (-2.5A) I3P A 2 ( 3.4A)	0.62A	3eeoA-3c5nA: undetectable	3eeoA-3c5nA: 18.90
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.	3LMY_A_CP6A562_1 (BETA-HEXOSAMINIDASE SUBUNIT BETA)	4qj4	1-PHOSPHATIDYLINOSIT OL 4,5-BISPHOSPHATE PHOSPHODIESTERASE BETA-3 (Homo sapiens)	5 / 12	ARG B 646 HIS B 332 ASP B 364 TYR B 350 LEU B 354	I3P B 902 (-3.7A) I3P B 902 (-4.1A) CA B 901 (-2.0A) None None	1.49A	3lmyA-4qj4B: 4.3	3lmyA-4qj4B: 21.43
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.	3M0W_B_P77B204_1 (PROTEIN S100-A4)	2a98	INOSITOL 1,4,5-TRISPHOSPHATE 3-KINASE C (Homo sapiens)	4 / 6	CYH A 485 GLU A 555 PHE A 568 PHE A 584	None I3P A 1 ( 4.4A) None None	1.40A	3m0wB-2a98A: undetectable 3m0wJ-2a98A: undetectable	3m0wB-2a98A: 16.99 3m0wJ-2a98A: 16.99

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1P93_D_DEXD4999_2","GLUCOCORTICOID RECEPTOR","2p0d","RHO GTPASE-ACTIVATING PROTEIN 9","Homo sapiens",4,"LEU A 403;TRP A 345;MET A 331;LEU A 329","None;I3P A 800 (-4.1A);None;None","1.35A","1p93D-2p0dA:undetectable",null],["3AQI_A_CHDA3_0","FERROCHELATASE","1n4k","INOSITOL 1,4,5-TRISPHOSPHATE RECEPTOR TYPE 1","Mus musculus",3,"PRO A 405;LEU A 416;ARG A 265","None;None;I3P A1000 (-3.0A)","0.89A","3aqiA-1n4kA:undetectable","1p93D-2p0dA:19.42"],["3EEO_A_SAMA328_1","MODIFICATION METHYLASE HHAI","3c5n","TUBBY-RELATED PROTEIN 1","Homo sapiens",3,"GLU A 458;SER A 434;VAL A 435","I3P A   2 ( 4.7A);I3P A   2 (-2.5A);I3P A   2 ( 3.4A)","0.62A","3eeoA-3c5nA:undetectable","3aqiA-1n4kA:22.88"],["3LMY_A_CP6A562_1","BETA-HEXOSAMINIDASE SUBUNIT BETA","4qj4","1-PHOSPHATIDYLINOSITOL 4,5-BISPHOSPHATE PHOSPHODIESTERASE BETA-3","Homo sapiens",5,"ARG B 646;HIS B 332;ASP B 364;TYR B 350;LEU B 354","I3P B 902 (-3.7A);I3P B 902 (-4.1A); CA B 901 (-2.0A);None;None","1.49A","3lmyA-4qj4B:4.3","3eeoA-3c5nA:18.90"],["3M0W_B_P77B204_1","PROTEIN S100-A4;PROTEIN S100-A4","2a98","INOSITOL 1,4,5-TRISPHOSPHATE 3-KINASE C","Homo sapiens",4,"CYH A 485;GLU A 555;PHE A 568;PHE A 584","None;I3P A   1 ( 4.4A);None;None","1.40A","3m0wB-2a98A:undetectable;3m0wJ-2a98A:undetectable","3lmyA-4qj4B:21.43"]]