SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3a1b'

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.	1P9G_A_ACTA42_0 (EAFP 2)	3a1b	DNA (CYTOSINE-5)-METHYLT RANSFERASE 3A, HISTONE H3.1 (Homo sapiens)	3 / 3	CYH A 540 ARG A 476 CYH A 559	ZN A 2 (-2.3A) ZN A 2 ( 4.9A) ZN A 2 ( 2.3A)	1.02A	1p9gA-3a1bA: undetectable	1p9gA-3a1bA: 13.33
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.	3T3S_C_9PLC1_1 (CYTOCHROME P450 2A13)	3a1b	DNA (CYTOSINE-5)-METHYLT RANSFERASE 3A, HISTONE H3.1 (Homo sapiens)	4 / 7	PHE A 609 PHE A 521 THR A 538 LEU A 508	None EDO A 615 ( 3.9A) EDO A 615 ( 4.3A) None	0.72A	3t3sC-3a1bA: undetectable	3t3sC-3a1bA: 13.90
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.	5HRQ_C_IPHC101_0 (INSULIN A-CHAIN INSULIN B-CHAIN)	3a1b	DNA (CYTOSINE-5)-METHYLT RANSFERASE 3A, HISTONE H3.1 (Homo sapiens)	4 / 5	CYH A 497 ILE A 495 CYH A 494 HIS A 506	ZN A 1 (-2.3A) None ZN A 1 (-2.2A) None	1.44A	5hrqC-3a1bA: undetectable 5hrqD-3a1bA: undetectable 5hrqL-3a1bA: undetectable	5hrqC-3a1bA: 16.47 5hrqD-3a1bA: 9.43 5hrqL-3a1bA: 9.43

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1P9G_A_ACTA42_0","EAFP 2","3a1b","DNA (CYTOSINE-5)-METHYLTRANSFERASE 3A, HISTONE H3.1","Homo sapiens",3,"CYH A 540;ARG A 476;CYH A 559"," ZN A   2 (-2.3A); ZN A   2 ( 4.9A); ZN A   2 ( 2.3A)","1.02A","1p9gA-3a1bA:undetectable","1p9gA-3a1bA:13.33"],["3T3S_C_9PLC1_1","CYTOCHROME P450 2A13","3a1b","DNA (CYTOSINE-5)-METHYLTRANSFERASE 3A, HISTONE H3.1","Homo sapiens",4,"PHE A 609;PHE A 521;THR A 538;LEU A 508","None;EDO A 615 ( 3.9A);EDO A 615 ( 4.3A);None","0.72A","3t3sC-3a1bA:undetectable","3t3sC-3a1bA:13.90"],["5HRQ_C_IPHC101_0","INSULIN A-CHAIN;INSULIN B-CHAIN","3a1b","DNA (CYTOSINE-5)-METHYLTRANSFERASE 3A, HISTONE H3.1","Homo sapiens",4,"CYH A 497;ILE A 495;CYH A 494;HIS A 506"," ZN A   1 (-2.3A);None; ZN A   1 (-2.2A);None","1.44A","5hrqC-3a1bA:undetectable;5hrqD-3a1bA:undetectable;5hrqL-3a1bA:undetectable","5hrqC-3a1bA:16.47;5hrqD-3a1bA:9.43;5hrqL-3a1bA:9.43"]]