SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1dbu'

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.	2JAP_B_J01B1249_1 (CLAVALDEHYDE DEHYDROGENASE)	1dbu	CYSTEINYL-TRNA(PRO) DEACYLASE (Haemophilus influenzae)	5 / 12	LEU A 64 SER A 78 ILE A 79 ALA A 75 THR A 114	None None None None HG A 260 (-3.2A)	1.24A	2japB-1dbuA: undetectable	2japB-1dbuA: 22.31
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.	2JAP_D_J01D1249_1 (CLAVALDEHYDE DEHYDROGENASE)	1dbu	CYSTEINYL-TRNA(PRO) DEACYLASE (Haemophilus influenzae)	5 / 12	LEU A 64 SER A 78 ILE A 79 ALA A 75 THR A 114	None None None None HG A 260 (-3.2A)	1.27A	2japD-1dbuA: undetectable	2japD-1dbuA: 22.31
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.	3KPD_C_SAMC1000_1 (UNCHARACTERIZED PROTEIN MJ0100)	1dbu	CYSTEINYL-TRNA(PRO) DEACYLASE (Haemophilus influenzae)	5 / 12	THR A 119 VAL A 63 ASN A 71 ILE A 155 VAL A 115	None	1.09A	3kpdC-1dbuA: 0.0	3kpdC-1dbuA: 27.74
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.	3V1N_A_BEZA288_0 (2-HYDROXY-6-OXO-6-PH ENYLHEXA-2,4-DIENOAT E HYDROLASE)	1dbu	CYSTEINYL-TRNA(PRO) DEACYLASE (Haemophilus influenzae)	5 / 8	GLY A 131 GLY A 130 SER A 104 ILE A 139 LEU A 8	None	1.38A	3v1nA-1dbuA: undetectable	3v1nA-1dbuA: 18.37

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2JAP_B_J01B1249_1","CLAVALDEHYDE DEHYDROGENASE","1dbu","CYSTEINYL-TRNA(PRO) DEACYLASE","Haemophilus influenzae",5,"LEU A  64;SER A  78;ILE A  79;ALA A  75;THR A 114","None;None;None;None; HG A 260 (-3.2A)","1.24A","2japB-1dbuA:undetectable","2japB-1dbuA:22.31"],["2JAP_D_J01D1249_1","CLAVALDEHYDE DEHYDROGENASE","1dbu","CYSTEINYL-TRNA(PRO) DEACYLASE","Haemophilus influenzae",5,"LEU A  64;SER A  78;ILE A  79;ALA A  75;THR A 114","None;None;None;None; HG A 260 (-3.2A)","1.27A","2japD-1dbuA:undetectable","2japD-1dbuA:22.31"],["3KPD_C_SAMC1000_1","UNCHARACTERIZED PROTEIN MJ0100","1dbu","CYSTEINYL-TRNA(PRO) DEACYLASE","Haemophilus influenzae",5,"THR A 119;VAL A  63;ASN A  71;ILE A 155;VAL A 115","None","1.09A","3kpdC-1dbuA:0.0","3kpdC-1dbuA:27.74"],["3V1N_A_BEZA288_0","2-HYDROXY-6-OXO-6-PHENYLHEXA-2,4-DIENOATE HYDROLASE","1dbu","CYSTEINYL-TRNA(PRO) DEACYLASE","Haemophilus influenzae",5,"GLY A 131;GLY A 130;SER A 104;ILE A 139;LEU A   8","None","1.38A","3v1nA-1dbuA:undetectable","3v1nA-1dbuA:18.37"]]