SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5iwx'

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.	1MZ9_A_VDYA1002_4 (CARTILAGE OLIGOMERIC MATRIX PROTEIN)	5iwx	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Bacillus subtilis)	4 / 5	LEU A 41 VAL A 45 ALA A 52 CYH A 49	None	1.13A	1mz9D-5iwxA: undetectable	1mz9D-5iwxA: 14.09
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.	2ACL_C_REAC503_1 (RETINOIC ACID RECEPTOR RXR-ALPHA)	5iwx	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Bacillus subtilis)	5 / 10	ILE A 147 ALA A 148 ALA A 149 GLN A 150 ILE A 26	None	0.94A	2aclC-5iwxA: undetectable	2aclC-5iwxA: 20.25
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.	2QHF_A_NCAA493_0 (CHORISMATE SYNTHASE)	5iwx	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Bacillus subtilis)	5 / 11	ILE A 95 ILE A 155 ALA A 52 ALA A 48 VAL A 45	None	1.16A	2qhfA-5iwxA: undetectable	2qhfA-5iwxA: 18.95
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.	3EKT_B_017B200_2 (PROTEASE)	5iwx	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Bacillus subtilis)	5 / 9	VAL A 130 GLY A 23 ILE A 20 ALA A 149 ILE A 99	None	1.08A	3ektB-5iwxA: undetectable	3ektB-5iwxA: 26.25
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.	3ME6_C_CGEC501_1 (CYTOCHROME P450 2B4)	5iwx	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Bacillus subtilis)	5 / 9	VAL A 85 ILE A 155 ALA A 123 VAL A 45 VAL A 153	None	1.23A	3me6C-5iwxA: undetectable	3me6C-5iwxA: 15.07
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.	3N3I_A_ROCA201_2 (PROTEASE)	5iwx	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Bacillus subtilis)	4 / 6	ILE A 100 PRO A 104 ASP A 112 ILE A 24	None	0.87A	3n3iA-5iwxA: undetectable	3n3iA-5iwxA: 22.22
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.	5VKQ_C_PCFC1805_0 (NO MECHANORECEPTOR POTENTIAL C ISOFORM L)	5iwx	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Bacillus subtilis)	5 / 9	GLY A 31 LEU A 19 ILE A 147 GLY A 146 ILE A 58	None	0.99A	5vkqC-5iwxA: undetectable 5vkqD-5iwxA: undetectable	5vkqC-5iwxA: 8.87 5vkqD-5iwxA: 8.87
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.	6C2M_B_SUEB1202_0 (NS3 PROTEASE)	5iwx	2-C-METHYL-D-ERYTHRI TOL 2,4-CYCLODIPHOSPHATE SYNTHASE (Bacillus subtilis)	5 / 12	PHE A 75 GLY A 120 VAL A 85 ILE A 99 GLY A 23	None	1.16A	6c2mB-5iwxA: undetectable	6c2mB-5iwxA: 20.75

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1MZ9_A_VDYA1002_4","CARTILAGE OLIGOMERIC MATRIX PROTEIN;CARTILAGE OLIGOMERIC MATRIX PROTEIN","5iwx","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Bacillus subtilis",4,"LEU A  41;VAL A  45;ALA A  52;CYH A  49","None","1.13A","1mz9D-5iwxA:undetectable","1mz9D-5iwxA:14.09"],["2ACL_C_REAC503_1","RETINOIC ACID RECEPTOR RXR-ALPHA","5iwx","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Bacillus subtilis",5,"ILE A 147;ALA A 148;ALA A 149;GLN A 150;ILE A  26","None","0.94A","2aclC-5iwxA:undetectable","2aclC-5iwxA:20.25"],["2QHF_A_NCAA493_0","CHORISMATE SYNTHASE","5iwx","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Bacillus subtilis",5,"ILE A  95;ILE A 155;ALA A  52;ALA A  48;VAL A  45","None","1.16A","2qhfA-5iwxA:undetectable","2qhfA-5iwxA:18.95"],["3EKT_B_017B200_2","PROTEASE","5iwx","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Bacillus subtilis",5,"VAL A 130;GLY A  23;ILE A  20;ALA A 149;ILE A  99","None","1.08A","3ektB-5iwxA:undetectable","3ektB-5iwxA:26.25"],["3ME6_C_CGEC501_1","CYTOCHROME P450 2B4","5iwx","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Bacillus subtilis",5,"VAL A  85;ILE A 155;ALA A 123;VAL A  45;VAL A 153","None","1.23A","3me6C-5iwxA:undetectable","3me6C-5iwxA:15.07"],["3N3I_A_ROCA201_2","PROTEASE","5iwx","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Bacillus subtilis",4,"ILE A 100;PRO A 104;ASP A 112;ILE A  24","None","0.87A","3n3iA-5iwxA:undetectable","3n3iA-5iwxA:22.22"],["5VKQ_C_PCFC1805_0","NO MECHANORECEPTOR POTENTIAL C ISOFORM L","5iwx","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Bacillus subtilis",5,"GLY A  31;LEU A  19;ILE A 147;GLY A 146;ILE A  58","None","0.99A","5vkqC-5iwxA:undetectable;5vkqD-5iwxA:undetectable","5vkqC-5iwxA:8.87;5vkqD-5iwxA:8.87"],["6C2M_B_SUEB1202_0","NS3 PROTEASE","5iwx","2-C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATE SYNTHASE","Bacillus subtilis",5,"PHE A  75;GLY A 120;VAL A  85;ILE A  99;GLY A  23","None","1.16A","6c2mB-5iwxA:undetectable","6c2mB-5iwxA:20.75"]]