SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2npu'

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.	4DRI_A_RAPA201_2 (PEPTIDYL-PROLYL CIS-TRANS ISOMERASE FKBP5 SERINE/THREONINE-PRO TEIN KINASE MTOR)	2npu	FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN (Homo sapiens)	6 / 10	LEU A2031 GLU A2032 SER A2035 THR A2098 TRP A2101 ASP A2102	None	0.91A	4driB-2npuA: 13.5	4driB-2npuA: 91.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	4DRJ_A_RAPA201_2 (PEPTIDYL-PROLYL CIS-TRANS ISOMERASE FKBP4 SERINE/THREONINE-PRO TEIN KINASE MTOR)	2npu	FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN (Homo sapiens)	4 / 8	SER A2035 TRP A2101 ASP A2102 TYR A2105	None	0.92A	4drjB-2npuA: 14.1	4drjB-2npuA: 91.26
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	4DRJ_A_RAPA201_2 (PEPTIDYL-PROLYL CIS-TRANS ISOMERASE FKBP4 SERINE/THREONINE-PRO TEIN KINASE MTOR)	2npu	FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN (Homo sapiens)	4 / 8	THR A2098 TRP A2101 ASP A2102 TYR A2105	None	0.81A	4drjB-2npuA: 14.1	4drjB-2npuA: 91.26
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.	5FLC_C_RAPC999_1 (SERINE/THREONINE-PRO TEIN KINASE MTOR FKBP)	2npu	FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN (Homo sapiens)	4 / 8	GLU A2032 GLY A2040 THR A2098 TRP A2101	None	0.94A	5flcB-2npuA: 13.9	5flcB-2npuA: 15.83
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.	5FLC_C_RAPC999_1 (SERINE/THREONINE-PRO TEIN KINASE MTOR FKBP)	2npu	FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN (Homo sapiens)	4 / 8	GLU A2032 SER A2035 GLY A2040 TRP A2101	None	0.96A	5flcB-2npuA: 13.9	5flcB-2npuA: 15.83
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.	5FLC_G_RAPG999_1 (SERINE/THREONINE-PRO TEIN KINASE MTOR FKBP)	2npu	FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN (Homo sapiens)	4 / 8	GLU A2032 GLY A2040 THR A2098 TRP A2101	None	0.94A	5flcF-2npuA: 14.0	5flcF-2npuA: 15.83
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.	5FLC_G_RAPG999_1 (SERINE/THREONINE-PRO TEIN KINASE MTOR FKBP)	2npu	FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN (Homo sapiens)	4 / 8	GLU A2032 SER A2035 GLY A2040 TRP A2101	None	0.95A	5flcF-2npuA: 14.0	5flcF-2npuA: 15.83
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.	5G5G_C_ACTC1740_0 (PUTATIVE XANTHINE DEHYDROGENASE YAGS FAD-BINDING SUBUNIT)	2npu	FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN (Homo sapiens)	4 / 4	VAL A2050 GLU A2033 GLY A2030 LEU A2054	None	1.34A	5g5gC-2npuA: undetectable	5g5gC-2npuA: 11.19

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["4DRI_A_RAPA201_2","PEPTIDYL-PROLYL CIS-TRANS ISOMERASE FKBP5;SERINE\/THREONINE-PROTEIN KINASE MTOR","2npu","FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN","Homo sapiens",6,"LEU A2031;GLU A2032;SER A2035;THR A2098;TRP A2101;ASP A2102","None","0.91A","4driB-2npuA:13.5","4driB-2npuA:91.26"],["4DRJ_A_RAPA201_2","PEPTIDYL-PROLYL CIS-TRANS ISOMERASE FKBP4;SERINE\/THREONINE-PROTEIN KINASE MTOR","2npu","FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN","Homo sapiens",4,"SER A2035;TRP A2101;ASP A2102;TYR A2105","None","0.92A","4drjB-2npuA:14.1","4drjB-2npuA:91.26"],["4DRJ_A_RAPA201_2","PEPTIDYL-PROLYL CIS-TRANS ISOMERASE FKBP4;SERINE\/THREONINE-PROTEIN KINASE MTOR","2npu","FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN","Homo sapiens",4,"THR A2098;TRP A2101;ASP A2102;TYR A2105","None","0.81A","4drjB-2npuA:14.1","4drjB-2npuA:91.26"],["5FLC_C_RAPC999_1","SERINE\/THREONINE-PROTEIN KINASE MTOR;FKBP","2npu","FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN","Homo sapiens",4,"GLU A2032;GLY A2040;THR A2098;TRP A2101","None","0.94A","5flcB-2npuA:13.9","5flcB-2npuA:15.83"],["5FLC_C_RAPC999_1","SERINE\/THREONINE-PROTEIN KINASE MTOR;FKBP","2npu","FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN","Homo sapiens",4,"GLU A2032;SER A2035;GLY A2040;TRP A2101","None","0.96A","5flcB-2npuA:13.9","5flcB-2npuA:15.83"],["5FLC_G_RAPG999_1","SERINE\/THREONINE-PROTEIN KINASE MTOR;FKBP","2npu","FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN","Homo sapiens",4,"GLU A2032;GLY A2040;THR A2098;TRP A2101","None","0.94A","5flcF-2npuA:14.0","5flcF-2npuA:15.83"],["5FLC_G_RAPG999_1","SERINE\/THREONINE-PROTEIN KINASE MTOR;FKBP","2npu","FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN","Homo sapiens",4,"GLU A2032;SER A2035;GLY A2040;TRP A2101","None","0.95A","5flcF-2npuA:14.0","5flcF-2npuA:15.83"],["5G5G_C_ACTC1740_0","PUTATIVE XANTHINE DEHYDROGENASE YAGS FAD-BINDING SUBUNIT","2npu","FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN","Homo sapiens",4,"VAL A2050;GLU A2033;GLY A2030;LEU A2054","None","1.34A","5g5gC-2npuA:undetectable","5g5gC-2npuA:11.19"]]