SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'RIE'

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.	1HWI_A_115A2_1 (HMG-COA REDUCTASE)	2r4f	3-HYDROXY-3-METHYLGL UTARYL-COENZYME A REDUCTASE (Homo sapiens)	9 / 9	ARG A 590 MET A 657 SER A 661 VAL A 683 SER A 684 ASN A 686 ASP A 690 LYS A 691 LYS A 692	RIE A 876 (-2.9A) RIE A 876 (-4.1A) RIE A 876 (-2.9A) RIE A 876 ( 4.4A) RIE A 876 (-2.5A) RIE A 876 ( 4.8A) RIE A 876 (-3.6A) RIE A 876 (-2.8A) RIE A 876 (-3.1A)	0.37A	1hwiA-2r4fA: 53.3	1hwiA-2r4fA: 95.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	1HWI_B_115B1_2 (HMG-COA REDUCTASE)	2r4f	3-HYDROXY-3-METHYLGL UTARYL-COENZYME A REDUCTASE (Homo sapiens)	8 / 8	ARG A 590 SER A 661 VAL A 683 SER A 684 ASN A 686 ASP A 690 LYS A 691 LYS A 692	RIE A 876 (-2.9A) RIE A 876 (-2.9A) RIE A 876 ( 4.4A) RIE A 876 (-2.5A) RIE A 876 ( 4.8A) RIE A 876 (-3.6A) RIE A 876 (-2.8A) RIE A 876 (-3.1A)	0.36A	1hwiB-2r4fA: 53.5	1hwiB-2r4fA: 95.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	1HWI_C_115C4_1 (HMG-COA REDUCTASE)	2r4f	3-HYDROXY-3-METHYLGL UTARYL-COENZYME A REDUCTASE (Homo sapiens)	7 / 7	ARG A 590 VAL A 683 SER A 684 ASN A 686 ASP A 690 LYS A 691 LYS A 692	RIE A 876 (-2.9A) RIE A 876 ( 4.4A) RIE A 876 (-2.5A) RIE A 876 ( 4.8A) RIE A 876 (-3.6A) RIE A 876 (-2.8A) RIE A 876 (-3.1A)	0.29A	1hwiC-2r4fA: 40.5	1hwiC-2r4fA: 95.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	1HWI_D_115D3_2 (HMG-COA REDUCTASE)	2r4f	3-HYDROXY-3-METHYLGL UTARYL-COENZYME A REDUCTASE (Homo sapiens)	7 / 7	ARG A 590 VAL A 683 SER A 684 ASN A 686 ASP A 690 LYS A 691 LYS A 692	RIE A 876 (-2.9A) RIE A 876 ( 4.4A) RIE A 876 (-2.5A) RIE A 876 ( 4.8A) RIE A 876 (-3.6A) RIE A 876 (-2.8A) RIE A 876 (-3.1A)	0.30A	1hwiD-2r4fA: 40.7	1hwiD-2r4fA: 95.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	1HWK_A_117A2_1 (HMG-COA REDUCTASE)	2r4f	3-HYDROXY-3-METHYLGL UTARYL-COENZYME A REDUCTASE (Homo sapiens)	8 / 8	ARG A 590 SER A 661 VAL A 683 SER A 684 ASN A 686 ASP A 690 LYS A 691 LYS A 692	RIE A 876 (-2.9A) RIE A 876 (-2.9A) RIE A 876 ( 4.4A) RIE A 876 (-2.5A) RIE A 876 ( 4.8A) RIE A 876 (-3.6A) RIE A 876 (-2.8A) RIE A 876 (-3.1A)	0.20A	1hwkA-2r4fA: 53.9	1hwkA-2r4fA: 95.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	1HWK_B_117B1_2 (HMG-COA REDUCTASE)	2r4f	3-HYDROXY-3-METHYLGL UTARYL-COENZYME A REDUCTASE (Homo sapiens)	9 / 9	ARG A 590 MET A 657 SER A 661 VAL A 683 SER A 684 ASN A 686 ASP A 690 LYS A 691 LYS A 692	RIE A 876 (-2.9A) RIE A 876 (-4.1A) RIE A 876 (-2.9A) RIE A 876 ( 4.4A) RIE A 876 (-2.5A) RIE A 876 ( 4.8A) RIE A 876 (-3.6A) RIE A 876 (-2.8A) RIE A 876 (-3.1A)	0.38A	1hwkB-2r4fA: 53.9	1hwkB-2r4fA: 95.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	1HWK_C_117C4_1 (HMG-COA REDUCTASE)	2r4f	3-HYDROXY-3-METHYLGL UTARYL-COENZYME A REDUCTASE (Homo sapiens)	8 / 8	ARG A 590 SER A 661 VAL A 683 SER A 684 ASN A 686 ASP A 690 LYS A 691 LYS A 692	RIE A 876 (-2.9A) RIE A 876 (-2.9A) RIE A 876 ( 4.4A) RIE A 876 (-2.5A) RIE A 876 ( 4.8A) RIE A 876 (-3.6A) RIE A 876 (-2.8A) RIE A 876 (-3.1A)	0.18A	1hwkC-2r4fA: 41.0	1hwkC-2r4fA: 95.81
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.	1HWK_D_117D3_2 (HMG-COA REDUCTASE)	2r4f	3-HYDROXY-3-METHYLGL UTARYL-COENZYME A REDUCTASE (Homo sapiens)	8 / 8	ARG A 590 SER A 661 VAL A 683 SER A 684 ASN A 686 ASP A 690 LYS A 691 LYS A 692	RIE A 876 (-2.9A) RIE A 876 (-2.9A) RIE A 876 ( 4.4A) RIE A 876 (-2.5A) RIE A 876 ( 4.8A) RIE A 876 (-3.6A) RIE A 876 (-2.8A) RIE A 876 (-3.1A)	0.18A	1hwkD-2r4fA: 41.1	1hwkD-2r4fA: 95.81
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.	2HMA_A_SAMA375_0 (PROBABLE TRNA (5-METHYLAMINOMETHYL -2-THIOURIDYLATE)-ME THYLTRANSFERASE)	2r4f	3-HYDROXY-3-METHYLGL UTARYL-COENZYME A REDUCTASE (Homo sapiens)	5 / 11	GLY A 591 SER A 684 ASN A 697 THR A 589 GLN A 770	None RIE A 876 (-2.5A) None None None	1.34A	2hmaA-2r4fA: undetectable	2hmaA-2r4fA: 21.52
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.	4A6N_C_T1CC392_1 (TETX2 PROTEIN)	2r4f	3-HYDROXY-3-METHYLGL UTARYL-COENZYME A REDUCTASE (Homo sapiens)	5 / 11	ASN A 686 MET A 588 GLY A 591 SER A 684 GLY A 773	RIE A 876 ( 4.8A) None None RIE A 876 (-2.5A) None	1.47A	4a6nC-2r4fA: undetectable	4a6nC-2r4fA: 23.52
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.	4ZDY_A_1YNA602_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	2r4f	3-HYDROXY-3-METHYLGL UTARYL-COENZYME A REDUCTASE (Homo sapiens)	5 / 12	GLY A 806 ILE A 696 GLY A 591 THR A 664 MET A 657	SO4 A 1 ( 4.6A) None None None RIE A 876 (-4.1A)	1.14A	4zdyA-2r4fA: undetectable	4zdyA-2r4fA: 22.32
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.	5ESL_A_1YNA701_1 (LANOSTEROL 14-ALPHA DEMETHYLASE)	2r4f	3-HYDROXY-3-METHYLGL UTARYL-COENZYME A REDUCTASE (Homo sapiens)	5 / 12	GLY A 806 ILE A 696 GLY A 591 THR A 664 MET A 657	SO4 A 1 ( 4.6A) None None None RIE A 876 (-4.1A)	1.11A	5eslA-2r4fA: undetectable	5eslA-2r4fA: 22.14

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1HWI_A_115A2_1","HMG-COA REDUCTASE","2r4f","3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE","Homo sapiens",9,"ARG A 590;MET A 657;SER A 661;VAL A 683;SER A 684;ASN A 686;ASP A 690;LYS A 691;LYS A 692","RIE A 876 (-2.9A);RIE A 876 (-4.1A);RIE A 876 (-2.9A);RIE A 876 ( 4.4A);RIE A 876 (-2.5A);RIE A 876 ( 4.8A);RIE A 876 (-3.6A);RIE A 876 (-2.8A);RIE A 876 (-3.1A)","0.37A","1hwiA-2r4fA:53.3",null],["1HWI_B_115B1_2","HMG-COA REDUCTASE","2r4f","3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE","Homo sapiens",8,"ARG A 590;SER A 661;VAL A 683;SER A 684;ASN A 686;ASP A 690;LYS A 691;LYS A 692","RIE A 876 (-2.9A);RIE A 876 (-2.9A);RIE A 876 ( 4.4A);RIE A 876 (-2.5A);RIE A 876 ( 4.8A);RIE A 876 (-3.6A);RIE A 876 (-2.8A);RIE A 876 (-3.1A)","0.36A","1hwiB-2r4fA:53.5","1hwiA-2r4fA:95.81"],["1HWI_C_115C4_1","HMG-COA REDUCTASE","2r4f","3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE","Homo sapiens",7,"ARG A 590;VAL A 683;SER A 684;ASN A 686;ASP A 690;LYS A 691;LYS A 692","RIE A 876 (-2.9A);RIE A 876 ( 4.4A);RIE A 876 (-2.5A);RIE A 876 ( 4.8A);RIE A 876 (-3.6A);RIE A 876 (-2.8A);RIE A 876 (-3.1A)","0.29A","1hwiC-2r4fA:40.5","1hwiB-2r4fA:95.81"],["1HWI_D_115D3_2","HMG-COA REDUCTASE","2r4f","3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE","Homo sapiens",7,"ARG A 590;VAL A 683;SER A 684;ASN A 686;ASP A 690;LYS A 691;LYS A 692","RIE A 876 (-2.9A);RIE A 876 ( 4.4A);RIE A 876 (-2.5A);RIE A 876 ( 4.8A);RIE A 876 (-3.6A);RIE A 876 (-2.8A);RIE A 876 (-3.1A)","0.30A","1hwiD-2r4fA:40.7","1hwiC-2r4fA:95.81"],["1HWK_A_117A2_1","HMG-COA REDUCTASE","2r4f","3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE","Homo sapiens",8,"ARG A 590;SER A 661;VAL A 683;SER A 684;ASN A 686;ASP A 690;LYS A 691;LYS A 692","RIE A 876 (-2.9A);RIE A 876 (-2.9A);RIE A 876 ( 4.4A);RIE A 876 (-2.5A);RIE A 876 ( 4.8A);RIE A 876 (-3.6A);RIE A 876 (-2.8A);RIE A 876 (-3.1A)","0.20A","1hwkA-2r4fA:53.9","1hwiD-2r4fA:95.81"],["1HWK_B_117B1_2","HMG-COA REDUCTASE","2r4f","3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE","Homo sapiens",9,"ARG A 590;MET A 657;SER A 661;VAL A 683;SER A 684;ASN A 686;ASP A 690;LYS A 691;LYS A 692","RIE A 876 (-2.9A);RIE A 876 (-4.1A);RIE A 876 (-2.9A);RIE A 876 ( 4.4A);RIE A 876 (-2.5A);RIE A 876 ( 4.8A);RIE A 876 (-3.6A);RIE A 876 (-2.8A);RIE A 876 (-3.1A)","0.38A","1hwkB-2r4fA:53.9","1hwkA-2r4fA:95.81"],["1HWK_C_117C4_1","HMG-COA REDUCTASE","2r4f","3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE","Homo sapiens",8,"ARG A 590;SER A 661;VAL A 683;SER A 684;ASN A 686;ASP A 690;LYS A 691;LYS A 692","RIE A 876 (-2.9A);RIE A 876 (-2.9A);RIE A 876 ( 4.4A);RIE A 876 (-2.5A);RIE A 876 ( 4.8A);RIE A 876 (-3.6A);RIE A 876 (-2.8A);RIE A 876 (-3.1A)","0.18A","1hwkC-2r4fA:41.0","1hwkB-2r4fA:95.81"],["1HWK_D_117D3_2","HMG-COA REDUCTASE","2r4f","3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE","Homo sapiens",8,"ARG A 590;SER A 661;VAL A 683;SER A 684;ASN A 686;ASP A 690;LYS A 691;LYS A 692","RIE A 876 (-2.9A);RIE A 876 (-2.9A);RIE A 876 ( 4.4A);RIE A 876 (-2.5A);RIE A 876 ( 4.8A);RIE A 876 (-3.6A);RIE A 876 (-2.8A);RIE A 876 (-3.1A)","0.18A","1hwkD-2r4fA:41.1","1hwkC-2r4fA:95.81"],["2HMA_A_SAMA375_0","PROBABLE TRNA (5-METHYLAMINOMETHYL-2-THIOURIDYLATE)-METHYLTRANSFERASE","2r4f","3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE","Homo sapiens",5,"GLY A 591;SER A 684;ASN A 697;THR A 589;GLN A 770","None;RIE A 876 (-2.5A);None;None;None","1.34A","2hmaA-2r4fA:undetectable","1hwkD-2r4fA:95.81"],["4A6N_C_T1CC392_1","TETX2 PROTEIN","2r4f","3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE","Homo sapiens",5,"ASN A 686;MET A 588;GLY A 591;SER A 684;GLY A 773","RIE A 876 ( 4.8A);None;None;RIE A 876 (-2.5A);None","1.47A","4a6nC-2r4fA:undetectable","2hmaA-2r4fA:21.52"],["4ZDY_A_1YNA602_1","LANOSTEROL 14-ALPHA DEMETHYLASE","2r4f","3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE","Homo sapiens",5,"GLY A 806;ILE A 696;GLY A 591;THR A 664;MET A 657","SO4 A   1 ( 4.6A);None;None;None;RIE A 876 (-4.1A)","1.14A","4zdyA-2r4fA:undetectable","4a6nC-2r4fA:23.52"],["5ESL_A_1YNA701_1","LANOSTEROL 14-ALPHA DEMETHYLASE","2r4f","3-HYDROXY-3-METHYLGLUTARYL-COENZYME A REDUCTASE","Homo sapiens",5,"GLY A 806;ILE A 696;GLY A 591;THR A 664;MET A 657","SO4 A   1 ( 4.6A);None;None;None;RIE A 876 (-4.1A)","1.11A","5eslA-2r4fA:undetectable","4zdyA-2r4fA:22.32"]]