SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1xbz'

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.	1RMT_D_ADND1504_1 (CLASS B ACID PHOSPHATASE)	1xbz	3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE (Escherichia coli)	4 / 8	ASP A 16 LEU A 38 THR A 21 TYR A 19	None	1.06A	1rmtD-1xbzA: undetectable	1rmtD-1xbzA: 24.27
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)	1xbz	3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE (Escherichia coli)	5 / 12	LEU A 50 ILE A 25 ALA A 26 VAL A 8 TYR A 54	None	1.21A	2japB-1xbzA: 3.3	2japB-1xbzA: 25.86
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)	1xbz	3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE (Escherichia coli)	5 / 12	LEU A 50 ILE A 25 ALA A 26 VAL A 8 TYR A 54	None	1.19A	2japD-1xbzA: 3.6	2japD-1xbzA: 25.86
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.	2O4P_A_TPVA300_2 (PROTEASE)	1xbz	3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE (Escherichia coli)	6 / 9	ARG A 23 LEU A 24 ALA A 204 VAL A 29 GLY A 191 ILE A 25	None None None None LX1 A 501 (-3.5A) None	1.48A	2o4pB-1xbzA: undetectable	2o4pB-1xbzA: 18.78
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.	3C6G_B_VD3B700_1 (CYTOCHROME P450 2R1)	1xbz	3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE (Escherichia coli)	5 / 12	PHE A 77 ALA A 63 ALA A 98 VAL A 101 GLY A 107	None	1.01A	3c6gB-1xbzA: undetectable	3c6gB-1xbzA: 18.70
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.	3EKP_B_478B200_1 (PROTEASE)	1xbz	3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE (Escherichia coli)	5 / 8	LEU A 24 ALA A 204 VAL A 29 GLY A 191 ILE A 25	None None None LX1 A 501 (-3.5A) None	1.17A	3ekpA-1xbzA: undetectable	3ekpA-1xbzA: 20.56
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.	3IJD_A_C2FA314_0 (UNCHARACTERIZED PROTEIN)	1xbz	3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE (Escherichia coli)	5 / 12	THR A 22 TYR A 19 LEU A 10 GLY A 41 LEU A 50	None	1.11A	3ijdA-1xbzA: 7.0	3ijdA-1xbzA: 22.12
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.	3N8Y_A_DIFA701_1 (PROSTAGLANDIN G/H SYNTHASE 1)	1xbz	3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE (Escherichia coli)	5 / 11	LEU A 6 ILE A 189 GLY A 191 ALA A 9 LEU A 10	None LX1 A 501 (-4.0A) LX1 A 501 (-3.5A) LX1 A 501 (-3.4A) None	1.18A	3n8yA-1xbzA: undetectable	3n8yA-1xbzA: 17.17
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.	4M48_A_21BA704_1 (TRANSPORTER)	1xbz	3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE (Escherichia coli)	5 / 8	PHE A 164 VAL A 109 ASP A 108 GLY A 131 ALA A 95	None	1.21A	4m48A-1xbzA: undetectable	4m48A-1xbzA: 16.82
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.	4QGI_A_ROCA101_2 (PROTEASE)	1xbz	3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE (Escherichia coli)	6 / 11	ARG A 23 LEU A 24 ALA A 204 VAL A 29 GLY A 191 ILE A 25	None None None None LX1 A 501 (-3.5A) None	1.50A	4qgiB-1xbzA: undetectable	4qgiB-1xbzA: 18.52
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.	4R38_D_RBFD201_2 (BLUE-LIGHT-ACTIVATED HISTIDINE KINASE 2)	1xbz	3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE (Escherichia coli)	4 / 8	LEU A 53 VAL A 34 LEU A 10 ILE A 32	None	0.87A	4r38D-1xbzA: undetectable	4r38D-1xbzA: 20.45
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.	5K9D_A_CE9A402_0 (DIHYDROOROTATE DEHYDROGENASE (QUINONE), MITOCHONDRIAL)	1xbz	3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE (Escherichia coli)	5 / 12	ALA A 102 LEU A 99 ALA A 98 THR A 94 LEU A 72	None	1.12A	5k9dA-1xbzA: 8.2	5k9dA-1xbzA: 22.60

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1RMT_D_ADND1504_1","CLASS B ACID PHOSPHATASE","1xbz","3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE","Escherichia coli",4,"ASP A  16;LEU A  38;THR A  21;TYR A  19","None","1.06A","1rmtD-1xbzA:undetectable","1rmtD-1xbzA:24.27"],["2JAP_B_J01B1249_1","CLAVALDEHYDE DEHYDROGENASE","1xbz","3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE","Escherichia coli",5,"LEU A  50;ILE A  25;ALA A  26;VAL A   8;TYR A  54","None","1.21A","2japB-1xbzA:3.3","2japB-1xbzA:25.86"],["2JAP_D_J01D1249_1","CLAVALDEHYDE DEHYDROGENASE","1xbz","3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE","Escherichia coli",5,"LEU A  50;ILE A  25;ALA A  26;VAL A   8;TYR A  54","None","1.19A","2japD-1xbzA:3.6","2japD-1xbzA:25.86"],["2O4P_A_TPVA300_2","PROTEASE;PROTEASE","1xbz","3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE","Escherichia coli",6,"ARG A  23;LEU A  24;ALA A 204;VAL A  29;GLY A 191;ILE A  25","None;None;None;None;LX1 A 501 (-3.5A);None","1.48A","2o4pB-1xbzA:undetectable","2o4pB-1xbzA:18.78"],["3C6G_B_VD3B700_1","CYTOCHROME P450 2R1","1xbz","3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE","Escherichia coli",5,"PHE A  77;ALA A  63;ALA A  98;VAL A 101;GLY A 107","None","1.01A","3c6gB-1xbzA:undetectable","3c6gB-1xbzA:18.70"],["3EKP_B_478B200_1","PROTEASE;PROTEASE","1xbz","3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE","Escherichia coli",5,"LEU A  24;ALA A 204;VAL A  29;GLY A 191;ILE A  25","None;None;None;LX1 A 501 (-3.5A);None","1.17A","3ekpA-1xbzA:undetectable","3ekpA-1xbzA:20.56"],["3IJD_A_C2FA314_0","UNCHARACTERIZED PROTEIN","1xbz","3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE","Escherichia coli",5,"THR A  22;TYR A  19;LEU A  10;GLY A  41;LEU A  50","None","1.11A","3ijdA-1xbzA:7.0","3ijdA-1xbzA:22.12"],["3N8Y_A_DIFA701_1","PROSTAGLANDIN G\/H SYNTHASE 1","1xbz","3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE","Escherichia coli",5,"LEU A   6;ILE A 189;GLY A 191;ALA A   9;LEU A  10","None;LX1 A 501 (-4.0A);LX1 A 501 (-3.5A);LX1 A 501 (-3.4A);None","1.18A","3n8yA-1xbzA:undetectable","3n8yA-1xbzA:17.17"],["4M48_A_21BA704_1","TRANSPORTER","1xbz","3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE","Escherichia coli",5,"PHE A 164;VAL A 109;ASP A 108;GLY A 131;ALA A  95","None","1.21A","4m48A-1xbzA:undetectable","4m48A-1xbzA:16.82"],["4QGI_A_ROCA101_2","PROTEASE;PROTEASE","1xbz","3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE","Escherichia coli",6,"ARG A  23;LEU A  24;ALA A 204;VAL A  29;GLY A 191;ILE A  25","None;None;None;None;LX1 A 501 (-3.5A);None","1.50A","4qgiB-1xbzA:undetectable","4qgiB-1xbzA:18.52"],["4R38_D_RBFD201_2","BLUE-LIGHT-ACTIVATED HISTIDINE KINASE 2","1xbz","3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE","Escherichia coli",4,"LEU A  53;VAL A  34;LEU A  10;ILE A  32","None","0.87A","4r38D-1xbzA:undetectable","4r38D-1xbzA:20.45"],["5K9D_A_CE9A402_0","DIHYDROOROTATE DEHYDROGENASE (QUINONE), MITOCHONDRIAL","1xbz","3-KETO-L-GULONATE 6-PHOSPHATE DECARBOXYLASE","Escherichia coli",5,"ALA A 102;LEU A  99;ALA A  98;THR A  94;LEU A  72","None","1.12A","5k9dA-1xbzA:8.2","5k9dA-1xbzA:22.60"]]