SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4CS'

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.	1JQD_A_HSMA600_1 (HISTAMINE N-METHYLTRANSFERASE)	2vpn	PERIPLASMIC SUBSTRATE BINDING PROTEIN (Halomonas elongata)	4 / 7	PHE A 187 GLU A 121 GLN A 15 TRP A 188	None 4CS A1311 ( 4.4A) 4CS A1311 ( 4.6A) 4CS A1311 (-3.6A)	1.47A	1jqdA-2vpnA: undetectable	1jqdA-2vpnA: 19.88
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.	2AOX_A_THAA400_1 (HISTAMINE N-METHYLTRANSFERASE)	2vpn	PERIPLASMIC SUBSTRATE BINDING PROTEIN (Halomonas elongata)	4 / 8	PHE A 187 GLU A 121 GLN A 15 TRP A 188	None 4CS A1311 ( 4.4A) 4CS A1311 ( 4.6A) 4CS A1311 (-3.6A)	1.46A	2aoxA-2vpnA: undetectable	2aoxA-2vpnA: 19.88
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.	2AOX_A_THAA400_1 (HISTAMINE N-METHYLTRANSFERASE)	2vpn	PERIPLASMIC SUBSTRATE BINDING PROTEIN (Halomonas elongata)	4 / 8	PHE A 209 GLU A 121 GLN A 15 TYR A 10	4CS A1311 (-3.6A) 4CS A1311 ( 4.4A) 4CS A1311 ( 4.6A) None	1.50A	2aoxA-2vpnA: undetectable	2aoxA-2vpnA: 19.88
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.	2AOX_B_THAB401_1 (HISTAMINE N-METHYLTRANSFERASE)	2vpn	PERIPLASMIC SUBSTRATE BINDING PROTEIN (Halomonas elongata)	4 / 7	PHE A 187 GLU A 121 GLN A 15 TRP A 188	None 4CS A1311 ( 4.4A) 4CS A1311 ( 4.6A) 4CS A1311 (-3.6A)	1.46A	2aoxB-2vpnA: 0.4	2aoxB-2vpnA: 19.88
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.	4TWD_H_377H401_1 (CYS-LOOP LIGAND-GATED ION CHANNEL)	3fxb	TRAP DICARBOXYLATE TRANSPORTER, DCTP SUBUNIT (Ruegeria pomeroyi)	4 / 6	ASN A 184 GLU A 9 GLU A 8 PHE A 66	4CS A 401 (-3.0A) 4CS A 401 (-3.7A) 4CS A 401 ( 4.6A) 4CS A 401 (-4.4A)	1.28A	4twdG-3fxbA: undetectable 4twdH-3fxbA: undetectable	4twdG-3fxbA: 23.12 4twdH-3fxbA: 23.12
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.	5X23_A_LSNA502_2 (CYTOCHROME P450 2C9)	4q0m	L-ASPARAGINASE (Pyrococcus furiosus)	3 / 3	LEU A 194 VAL A 61 ASP A 62	4CS A 405 (-4.9A) None None	0.56A	5x23A-4q0mA: undetectable	5x23A-4q0mA: 21.81

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1JQD_A_HSMA600_1","HISTAMINE N-METHYLTRANSFERASE","2vpn","PERIPLASMIC SUBSTRATE BINDING PROTEIN","Halomonas elongata",4,"PHE A 187;GLU A 121;GLN A  15;TRP A 188","None;4CS A1311 ( 4.4A);4CS A1311 ( 4.6A);4CS A1311 (-3.6A)","1.47A","1jqdA-2vpnA:undetectable",null],["2AOX_A_THAA400_1","HISTAMINE N-METHYLTRANSFERASE","2vpn","PERIPLASMIC SUBSTRATE BINDING PROTEIN","Halomonas elongata",4,"PHE A 187;GLU A 121;GLN A  15;TRP A 188","None;4CS A1311 ( 4.4A);4CS A1311 ( 4.6A);4CS A1311 (-3.6A)","1.46A","2aoxA-2vpnA:undetectable","1jqdA-2vpnA:19.88"],["2AOX_A_THAA400_1","HISTAMINE N-METHYLTRANSFERASE","2vpn","PERIPLASMIC SUBSTRATE BINDING PROTEIN","Halomonas elongata",4,"PHE A 209;GLU A 121;GLN A  15;TYR A  10","4CS A1311 (-3.6A);4CS A1311 ( 4.4A);4CS A1311 ( 4.6A);None","1.50A","2aoxA-2vpnA:undetectable","2aoxA-2vpnA:19.88"],["2AOX_B_THAB401_1","HISTAMINE N-METHYLTRANSFERASE","2vpn","PERIPLASMIC SUBSTRATE BINDING PROTEIN","Halomonas elongata",4,"PHE A 187;GLU A 121;GLN A  15;TRP A 188","None;4CS A1311 ( 4.4A);4CS A1311 ( 4.6A);4CS A1311 (-3.6A)","1.46A","2aoxB-2vpnA:0.4","2aoxA-2vpnA:19.88"],["4TWD_H_377H401_1","CYS-LOOP LIGAND-GATED ION CHANNEL;CYS-LOOP LIGAND-GATED ION CHANNEL","3fxb","TRAP DICARBOXYLATE TRANSPORTER, DCTP SUBUNIT","Ruegeria pomeroyi",4,"ASN A 184;GLU A   9;GLU A   8;PHE A  66","4CS A 401 (-3.0A);4CS A 401 (-3.7A);4CS A 401 ( 4.6A);4CS A 401 (-4.4A)","1.28A","4twdG-3fxbA:undetectable;4twdH-3fxbA:undetectable","2aoxB-2vpnA:19.88"],["5X23_A_LSNA502_2","CYTOCHROME P450 2C9","4q0m","L-ASPARAGINASE","Pyrococcus furiosus",3,"LEU A 194;VAL A  61;ASP A  62","4CS A 405 (-4.9A);None;None","0.56A","5x23A-4q0mA:undetectable","4twdG-3fxbA:23.12;4twdH-3fxbA:23.12"]]