SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2JG'

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.	1JB0_A_PQNA2001_1 (PHOTOSYSTEM I P700 CHLOROPHYLL A APOPROTEIN A1)	4na3	POLYKETIDE SYNTHASE PKSJ (Bacillus subtilis)	5 / 9	PHE A 16 GLY A 202 ALA A 365 LEU A 361 GLY A 242	None None 2JG A 176 ( 3.8A) None None	1.27A	1jb0A-4na3A: undetectable	1jb0A-4na3A: 21.20
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.	2FK8_A_SAMA302_1 (METHOXY MYCOLIC ACID SYNTHASE 4)	4na3	POLYKETIDE SYNTHASE PKSJ (Bacillus subtilis)	3 / 3	SER A 178 THR A 205 GLN A 92	2JG A 176 ( 4.7A) None None	0.75A	2fk8A-4na3A: undetectable	2fk8A-4na3A: 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.	3PCQ_A_PQNA847_1 (PHOTOSYSTEM I P700 CHLOROPHYLL A APOPROTEIN A1)	4na3	POLYKETIDE SYNTHASE PKSJ (Bacillus subtilis)	5 / 9	PHE A 16 GLY A 202 ALA A 365 LEU A 361 GLY A 242	None None 2JG A 176 ( 3.8A) None None	1.27A	3pcqA-4na3A: undetectable	3pcqA-4na3A: 21.20
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.	4LS7_A_1X9A504_1 (3-OXOACYL-[ACYL-CARR IER-PROTEIN] SYNTHASE 2)	4na3	POLYKETIDE SYNTHASE PKSJ (Bacillus subtilis)	5 / 12	ALA A 175 HIS A 311 THR A 313 HIS A 360 GLY A 432	2JG A 176 ( 2.6A) None None 2JG A 176 ( 4.0A) 2JG A 176 ( 3.6A)	0.34A	4ls7A-4na3A: 47.9	4ls7A-4na3A: 25.04
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.	4LS7_B_1X9B503_1 (3-OXOACYL-[ACYL-CARR IER-PROTEIN] SYNTHASE 2)	4na3	POLYKETIDE SYNTHASE PKSJ (Bacillus subtilis)	5 / 12	ALA A 175 HIS A 311 THR A 313 HIS A 360 GLY A 432	2JG A 176 ( 2.6A) None None 2JG A 176 ( 4.0A) 2JG A 176 ( 3.6A)	0.35A	4ls7A-4na3A: 47.9 4ls7B-4na3A: 47.7	4ls7A-4na3A: 25.04 4ls7B-4na3A: 25.04
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.	5L8R_A_PQNA844_1 (PHOTOSYSTEM I P700 CHLOROPHYLL A APOPROTEIN A1)	4na3	POLYKETIDE SYNTHASE PKSJ (Bacillus subtilis)	5 / 9	PHE A 16 GLY A 202 ALA A 365 LEU A 361 GLY A 242	None None 2JG A 176 ( 3.8A) None None	1.29A	5l8rA-4na3A: undetectable	5l8rA-4na3A: 21.01
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.	5N5D_B_SAMB303_1 (METHYLTRANSFERASE)	4na3	POLYKETIDE SYNTHASE PKSJ (Bacillus subtilis)	4 / 7	GLY A 435 PHE A 431 SER A 177 ARG A 275	None None 2JG A 176 ( 4.0A) None	0.80A	5n5dB-4na3A: undetectable	5n5dB-4na3A: 16.86

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1JB0_A_PQNA2001_1","PHOTOSYSTEM I P700 CHLOROPHYLL A APOPROTEIN A1","4na3","POLYKETIDE SYNTHASE PKSJ","Bacillus subtilis",5,"PHE A  16;GLY A 202;ALA A 365;LEU A 361;GLY A 242","None;None;2JG A 176 ( 3.8A);None;None","1.27A","1jb0A-4na3A:undetectable",null],["2FK8_A_SAMA302_1","METHOXY MYCOLIC ACID SYNTHASE 4","4na3","POLYKETIDE SYNTHASE PKSJ","Bacillus subtilis",3,"SER A 178;THR A 205;GLN A  92","2JG A 176 ( 4.7A);None;None","0.75A","2fk8A-4na3A:undetectable","1jb0A-4na3A:21.20"],["3PCQ_A_PQNA847_1","PHOTOSYSTEM I P700 CHLOROPHYLL A APOPROTEIN A1","4na3","POLYKETIDE SYNTHASE PKSJ","Bacillus subtilis",5,"PHE A  16;GLY A 202;ALA A 365;LEU A 361;GLY A 242","None;None;2JG A 176 ( 3.8A);None;None","1.27A","3pcqA-4na3A:undetectable","2fk8A-4na3A:21.52"],["4LS7_A_1X9A504_1","3-OXOACYL-[ACYL-CARRIER-PROTEIN] SYNTHASE 2","4na3","POLYKETIDE SYNTHASE PKSJ","Bacillus subtilis",5,"ALA A 175;HIS A 311;THR A 313;HIS A 360;GLY A 432","2JG A 176 ( 2.6A);None;None;2JG A 176 ( 4.0A);2JG A 176 ( 3.6A)","0.34A","4ls7A-4na3A:47.9","3pcqA-4na3A:21.20"],["4LS7_B_1X9B503_1","3-OXOACYL-[ACYL-CARRIER-PROTEIN] SYNTHASE 2;3-OXOACYL-[ACYL-CARRIER-PROTEIN] SYNTHASE 2","4na3","POLYKETIDE SYNTHASE PKSJ","Bacillus subtilis",5,"ALA A 175;HIS A 311;THR A 313;HIS A 360;GLY A 432","2JG A 176 ( 2.6A);None;None;2JG A 176 ( 4.0A);2JG A 176 ( 3.6A)","0.35A","4ls7A-4na3A:47.9;4ls7B-4na3A:47.7","4ls7A-4na3A:25.04"],["5L8R_A_PQNA844_1","PHOTOSYSTEM I P700 CHLOROPHYLL A APOPROTEIN A1","4na3","POLYKETIDE SYNTHASE PKSJ","Bacillus subtilis",5,"PHE A  16;GLY A 202;ALA A 365;LEU A 361;GLY A 242","None;None;2JG A 176 ( 3.8A);None;None","1.29A","5l8rA-4na3A:undetectable","4ls7A-4na3A:25.04;4ls7B-4na3A:25.04"],["5N5D_B_SAMB303_1","METHYLTRANSFERASE","4na3","POLYKETIDE SYNTHASE PKSJ","Bacillus subtilis",4,"GLY A 435;PHE A 431;SER A 177;ARG A 275","None;None;2JG A 176 ( 4.0A);None","0.80A","5n5dB-4na3A:undetectable","5l8rA-4na3A:21.01"]]