SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'IHS'

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.	2A3B_B_CFFB2434_1 (CHITINASE)	4fdu	PUTATIVE MULTIPLE INOSITOL POLYPHOSPHATE HISTIDINE PHOSPHATASE 1 (Bacteroides thetaiotaomicron)	4 / 6	GLU A 196 ASP A 186 PHE A 185 ARG A 183	None None IHS A 501 ( 4.9A) IHS A 501 (-3.1A)	1.39A	2a3bB-4fduA: undetectable	2a3bB-4fduA: 22.39
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.	3AY0_A_ADNA401_1 (UNCHARACTERIZED PROTEIN MJ0883)	4fdu	PUTATIVE MULTIPLE INOSITOL POLYPHOSPHATE HISTIDINE PHOSPHATASE 1 (Bacteroides thetaiotaomicron)	5 / 10	PHE A 330 ALA A 324 VAL A 365 LEU A 297 PHE A 301	None IHS A 501 (-3.4A) None None None	1.06A	3ay0A-4fduA: undetectable	3ay0A-4fduA: 21.88
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.	5O4Y_A_CCSA14_0 (PHE-MAA-ASN-PRO-HIS- LEU-SER-TRP-SER-TRP- 9KK-9KK-ARG-CCS-GLY- NH2)	4fdu	PUTATIVE MULTIPLE INOSITOL POLYPHOSPHATE HISTIDINE PHOSPHATASE 1 (Bacteroides thetaiotaomicron)	4 / 6	PHE A 63 LEU A 114 ARG A 149 GLY A 60	None None IHS A 501 (-3.5A) None	1.11A	5o4yA-4fduA: undetectable	5o4yA-4fduA: 2.36
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.	5O4Y_F_CCSF14_0 (PHE-MAA-ASN-PRO-HIS- LEU-SER-TRP-SER-TRP- 9KK-9KK-ARG-CCS-GLY- NH2)	4fdu	PUTATIVE MULTIPLE INOSITOL POLYPHOSPHATE HISTIDINE PHOSPHATASE 1 (Bacteroides thetaiotaomicron)	4 / 6	PHE A 63 LEU A 114 ARG A 149 GLY A 60	None None IHS A 501 (-3.5A) None	1.05A	5o4yF-4fduA: undetectable	5o4yF-4fduA: 2.36

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2A3B_B_CFFB2434_1","CHITINASE","4fdu","PUTATIVE MULTIPLE INOSITOL POLYPHOSPHATE HISTIDINE PHOSPHATASE 1","Bacteroides thetaiotaomicron",4,"GLU A 196;ASP A 186;PHE A 185;ARG A 183","None;None;IHS A 501 ( 4.9A);IHS A 501 (-3.1A)","1.39A","2a3bB-4fduA:undetectable",null],["3AY0_A_ADNA401_1","UNCHARACTERIZED PROTEIN MJ0883","4fdu","PUTATIVE MULTIPLE INOSITOL POLYPHOSPHATE HISTIDINE PHOSPHATASE 1","Bacteroides thetaiotaomicron",5,"PHE A 330;ALA A 324;VAL A 365;LEU A 297;PHE A 301","None;IHS A 501 (-3.4A);None;None;None","1.06A","3ay0A-4fduA:undetectable","2a3bB-4fduA:22.39"],["5O4Y_A_CCSA14_0","PHE-MAA-ASN-PRO-HIS-LEU-SER-TRP-SER-TRP-9KK-9KK-ARG-CCS-GLY-NH2","4fdu","PUTATIVE MULTIPLE INOSITOL POLYPHOSPHATE HISTIDINE PHOSPHATASE 1","Bacteroides thetaiotaomicron",4,"PHE A  63;LEU A 114;ARG A 149;GLY A  60","None;None;IHS A 501 (-3.5A);None","1.11A","5o4yA-4fduA:undetectable","3ay0A-4fduA:21.88"],["5O4Y_F_CCSF14_0","PHE-MAA-ASN-PRO-HIS-LEU-SER-TRP-SER-TRP-9KK-9KK-ARG-CCS-GLY-NH2","4fdu","PUTATIVE MULTIPLE INOSITOL POLYPHOSPHATE HISTIDINE PHOSPHATASE 1","Bacteroides thetaiotaomicron",4,"PHE A  63;LEU A 114;ARG A 149;GLY A  60","None;None;IHS A 501 (-3.5A);None","1.05A","5o4yF-4fduA:undetectable","5o4yA-4fduA:2.36"]]