SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4nng'

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)

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	DrReposER ID / Desc.	Hit PDBID	Hit Macromolecule	Res. Matches	Interface	HETATM	RMSD	Dali Z-score	Seq. Identity (%)	View	Dock
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.	3CZH_A_D2VA602_2 (CYTOCHROME P450 2R1)	4nng	30S RIBOSOMAL PROTEIN S1 (Mycobacterium tuberculosis)	3 / 3	LEU A 360 GLU A 318 ILE A 317	None	0.54A	3czhA-4nngA: undetectable	3czhA-4nngA: 16.86
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.	3LN1_A_CELA682_1 (PROSTAGLANDIN G/H SYNTHASE 2)	4nng	30S RIBOSOMAL PROTEIN S1 (Mycobacterium tuberculosis)	5 / 12	ALA A 365 VAL A 321 GLY A 308 ALA A 309 LEU A 304	None	1.05A	3ln1A-4nngA: undetectable	3ln1A-4nngA: 15.88
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.	3LN1_B_CELB682_1 (PROSTAGLANDIN G/H SYNTHASE 2)	4nng	30S RIBOSOMAL PROTEIN S1 (Mycobacterium tuberculosis)	5 / 12	ALA A 365 VAL A 321 GLY A 308 ALA A 309 LEU A 304	None	1.05A	3ln1B-4nngA: undetectable	3ln1B-4nngA: 15.88
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.	3LN1_C_CELC682_1 (PROSTAGLANDIN G/H SYNTHASE 2)	4nng	30S RIBOSOMAL PROTEIN S1 (Mycobacterium tuberculosis)	5 / 12	ALA A 365 VAL A 321 GLY A 308 ALA A 309 LEU A 304	None	1.05A	3ln1C-4nngA: undetectable	3ln1C-4nngA: 15.88
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.	3LN1_D_CELD682_1 (PROSTAGLANDIN G/H SYNTHASE 2)	4nng	30S RIBOSOMAL PROTEIN S1 (Mycobacterium tuberculosis)	5 / 12	ALA A 365 VAL A 321 GLY A 308 ALA A 309 LEU A 304	None	1.04A	3ln1D-4nngA: undetectable	3ln1D-4nngA: 15.88
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.	3UJ7_B_SAMB302_1 (PHOSPHOETHANOLAMINE N-METHYLTRANSFERASE)	4nng	30S RIBOSOMAL PROTEIN S1 (Mycobacterium tuberculosis)	4 / 5	SER A 383 ASP A 374 ASP A 368 ILE A 296	None	0.96A	3uj7B-4nngA: undetectable	3uj7B-4nngA: 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.	4RS0_A_IBPA706_1 (PROSTAGLANDIN G/H SYNTHASE 2)	4nng	30S RIBOSOMAL PROTEIN S1 (Mycobacterium tuberculosis)	5 / 9	VAL A 321 LEU A 360 SER A 361 GLY A 299 ALA A 344	None	1.11A	4rs0A-4nngA: undetectable	4rs0A-4nngA: 15.88
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.	5JW1_B_CELB602_1 (PROSTAGLANDIN G/H SYNTHASE 2)	4nng	30S RIBOSOMAL PROTEIN S1 (Mycobacterium tuberculosis)	5 / 12	ALA A 365 VAL A 321 GLY A 308 ALA A 309 LEU A 304	None	0.99A	5jw1B-4nngA: undetectable	5jw1B-4nngA: 14.44
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.	5KIR_A_RCXA601_1 (PROSTAGLANDIN G/H SYNTHASE 2)	4nng	30S RIBOSOMAL PROTEIN S1 (Mycobacterium tuberculosis)	5 / 12	ALA A 365 VAL A 321 GLY A 308 ALA A 309 LEU A 304	None	1.02A	5kirA-4nngA: undetectable	5kirA-4nngA: 13.76
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.	5KIR_B_RCXB601_1 (PROSTAGLANDIN G/H SYNTHASE 2)	4nng	30S RIBOSOMAL PROTEIN S1 (Mycobacterium tuberculosis)	5 / 12	ALA A 365 VAL A 321 GLY A 308 ALA A 309 LEU A 304	None	1.10A	5kirB-4nngA: undetectable	5kirB-4nngA: 13.76

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["3CZH_A_D2VA602_2","CYTOCHROME P450 2R1","4nng","30S RIBOSOMAL PROTEIN S1","Mycobacterium tuberculosis",3,"LEU A 360;GLU A 318;ILE A 317","None","0.54A","3czhA-4nngA:undetectable","3czhA-4nngA:16.86"],["3LN1_A_CELA682_1","PROSTAGLANDIN G\/H SYNTHASE 2","4nng","30S RIBOSOMAL PROTEIN S1","Mycobacterium tuberculosis",5,"ALA A 365;VAL A 321;GLY A 308;ALA A 309;LEU A 304","None","1.05A","3ln1A-4nngA:undetectable","3ln1A-4nngA:15.88"],["3LN1_B_CELB682_1","PROSTAGLANDIN G\/H SYNTHASE 2","4nng","30S RIBOSOMAL PROTEIN S1","Mycobacterium tuberculosis",5,"ALA A 365;VAL A 321;GLY A 308;ALA A 309;LEU A 304","None","1.05A","3ln1B-4nngA:undetectable","3ln1B-4nngA:15.88"],["3LN1_C_CELC682_1","PROSTAGLANDIN G\/H SYNTHASE 2","4nng","30S RIBOSOMAL PROTEIN S1","Mycobacterium tuberculosis",5,"ALA A 365;VAL A 321;GLY A 308;ALA A 309;LEU A 304","None","1.05A","3ln1C-4nngA:undetectable","3ln1C-4nngA:15.88"],["3LN1_D_CELD682_1","PROSTAGLANDIN G\/H SYNTHASE 2","4nng","30S RIBOSOMAL PROTEIN S1","Mycobacterium tuberculosis",5,"ALA A 365;VAL A 321;GLY A 308;ALA A 309;LEU A 304","None","1.04A","3ln1D-4nngA:undetectable","3ln1D-4nngA:15.88"],["3UJ7_B_SAMB302_1","PHOSPHOETHANOLAMINE N-METHYLTRANSFERASE","4nng","30S RIBOSOMAL PROTEIN S1","Mycobacterium tuberculosis",4,"SER A 383;ASP A 374;ASP A 368;ILE A 296","None","0.96A","3uj7B-4nngA:undetectable","3uj7B-4nngA:21.43"],["4RS0_A_IBPA706_1","PROSTAGLANDIN G\/H SYNTHASE 2","4nng","30S RIBOSOMAL PROTEIN S1","Mycobacterium tuberculosis",5,"VAL A 321;LEU A 360;SER A 361;GLY A 299;ALA A 344","None","1.11A","4rs0A-4nngA:undetectable","4rs0A-4nngA:15.88"],["5JW1_B_CELB602_1","PROSTAGLANDIN G\/H SYNTHASE 2","4nng","30S RIBOSOMAL PROTEIN S1","Mycobacterium tuberculosis",5,"ALA A 365;VAL A 321;GLY A 308;ALA A 309;LEU A 304","None","0.99A","5jw1B-4nngA:undetectable","5jw1B-4nngA:14.44"],["5KIR_A_RCXA601_1","PROSTAGLANDIN G\/H SYNTHASE 2","4nng","30S RIBOSOMAL PROTEIN S1","Mycobacterium tuberculosis",5,"ALA A 365;VAL A 321;GLY A 308;ALA A 309;LEU A 304","None","1.02A","5kirA-4nngA:undetectable","5kirA-4nngA:13.76"],["5KIR_B_RCXB601_1","PROSTAGLANDIN G\/H SYNTHASE 2","4nng","30S RIBOSOMAL PROTEIN S1","Mycobacterium tuberculosis",5,"ALA A 365;VAL A 321;GLY A 308;ALA A 309;LEU A 304","None","1.10A","5kirB-4nngA:undetectable","5kirB-4nngA:13.76"]]