SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3ffu'

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.	1ACJ_A_THAA999_1 (ACETYLCHOLINESTERASE)	3ffu	PROBABLE PYROPHOSPHOHYDROLASE (Bdellovibrio bacteriovorus)	5 / 9	GLY A 54 GLU A 51 TRP A 121 HIS A 116 GLY A 38	GTP A4033 ( 4.0A) GTP A4033 (-3.5A) None None None	1.39A	1acjA-3ffuA: undetectable	1acjA-3ffuA: 16.21
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.	1L7F_A_BCZA801_0 (NEURAMINIDASE)	3ffu	PROBABLE PYROPHOSPHOHYDROLASE (Bdellovibrio bacteriovorus)	5 / 12	GLU A 74 LEU A 71 ILE A 99 GLU A 51 ARG A 40	MG A 156 (-2.3A) None GTP A4033 ( 4.9A) GTP A4033 (-3.5A) GTP A4033 (-3.1A)	1.30A	1l7fA-3ffuA: undetectable	1l7fA-3ffuA: 16.75
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.	1MX1_E_THAE5_1 (LIVER CARBOXYLESTERASE I)	3ffu	PROBABLE PYROPHOSPHOHYDROLASE (Bdellovibrio bacteriovorus)	5 / 12	GLY A 55 VAL A 24 LEU A 67 LEU A 29 HIS A 116	GTP A4033 (-2.8A) GTP A4033 (-4.4A) None None None	1.17A	1mx1E-3ffuA: undetectable	1mx1E-3ffuA: 14.37
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.	3VN2_A_TLSA501_1 (PEROXISOME PROLIFERATOR-ACTIVAT ED RECEPTOR GAMMA)	3ffu	PROBABLE PYROPHOSPHOHYDROLASE (Bdellovibrio bacteriovorus)	5 / 12	PHE A 52 HIS A 90 ILE A 97 LEU A 98 LEU A 84	GTP A4033 (-4.7A) None GTP A4033 (-4.5A) None None	1.39A	3vn2A-3ffuA: undetectable	3vn2A-3ffuA: 19.10
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.	4MWV_A_BCZA513_0 (NEURAMINIDASE)	3ffu	PROBABLE PYROPHOSPHOHYDROLASE (Bdellovibrio bacteriovorus)	5 / 12	GLU A 74 LEU A 71 ILE A 99 GLU A 51 ARG A 40	MG A 156 (-2.3A) None GTP A4033 ( 4.9A) GTP A4033 (-3.5A) GTP A4033 (-3.1A)	1.30A	4mwvA-3ffuA: undetectable	4mwvA-3ffuA: 17.01
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.	5ZWR_A_9KLA402_0 (EST-Y29)	3ffu	PROBABLE PYROPHOSPHOHYDROLASE (Bdellovibrio bacteriovorus)	5 / 12	PHE A 28 ILE A 143 LEU A 86 GLY A 54 ALA A 26	None None None GTP A4033 ( 4.0A) GTP A4033 ( 4.1A)	1.22A	5zwrA-3ffuA: undetectable	5zwrA-3ffuA: 14.21
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.	6FOS_A_PQNA2001_1 (PHOTOSYSTEM I P700 CHLOROPHYLL A APOPROTEIN A1)	3ffu	PROBABLE PYROPHOSPHOHYDROLASE (Bdellovibrio bacteriovorus)	4 / 6	GLY A 109 TRP A 107 ALA A 79 LEU A 71	None	1.02A	6fosA-3ffuA: undetectable	6fosA-3ffuA: 20.00

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["1ACJ_A_THAA999_1","ACETYLCHOLINESTERASE","3ffu","PROBABLE PYROPHOSPHOHYDROLASE","Bdellovibrio bacteriovorus",5,"GLY A  54;GLU A  51;TRP A 121;HIS A 116;GLY A  38","GTP A4033 ( 4.0A);GTP A4033 (-3.5A);None;None;None","1.39A","1acjA-3ffuA:undetectable","1acjA-3ffuA:16.21"],["1L7F_A_BCZA801_0","NEURAMINIDASE","3ffu","PROBABLE PYROPHOSPHOHYDROLASE","Bdellovibrio bacteriovorus",5,"GLU A  74;LEU A  71;ILE A  99;GLU A  51;ARG A  40"," MG A 156 (-2.3A);None;GTP A4033 ( 4.9A);GTP A4033 (-3.5A);GTP A4033 (-3.1A)","1.30A","1l7fA-3ffuA:undetectable","1l7fA-3ffuA:16.75"],["1MX1_E_THAE5_1","LIVER CARBOXYLESTERASE I","3ffu","PROBABLE PYROPHOSPHOHYDROLASE","Bdellovibrio bacteriovorus",5,"GLY A  55;VAL A  24;LEU A  67;LEU A  29;HIS A 116","GTP A4033 (-2.8A);GTP A4033 (-4.4A);None;None;None","1.17A","1mx1E-3ffuA:undetectable","1mx1E-3ffuA:14.37"],["3VN2_A_TLSA501_1","PEROXISOME PROLIFERATOR-ACTIVATED RECEPTOR GAMMA","3ffu","PROBABLE PYROPHOSPHOHYDROLASE","Bdellovibrio bacteriovorus",5,"PHE A  52;HIS A  90;ILE A  97;LEU A  98;LEU A  84","GTP A4033 (-4.7A);None;GTP A4033 (-4.5A);None;None","1.39A","3vn2A-3ffuA:undetectable","3vn2A-3ffuA:19.10"],["4MWV_A_BCZA513_0","NEURAMINIDASE","3ffu","PROBABLE PYROPHOSPHOHYDROLASE","Bdellovibrio bacteriovorus",5,"GLU A  74;LEU A  71;ILE A  99;GLU A  51;ARG A  40"," MG A 156 (-2.3A);None;GTP A4033 ( 4.9A);GTP A4033 (-3.5A);GTP A4033 (-3.1A)","1.30A","4mwvA-3ffuA:undetectable","4mwvA-3ffuA:17.01"],["5ZWR_A_9KLA402_0","EST-Y29","3ffu","PROBABLE PYROPHOSPHOHYDROLASE","Bdellovibrio bacteriovorus",5,"PHE A  28;ILE A 143;LEU A  86;GLY A  54;ALA A  26","None;None;None;GTP A4033 ( 4.0A);GTP A4033 ( 4.1A)","1.22A","5zwrA-3ffuA:undetectable","5zwrA-3ffuA:14.21"],["6FOS_A_PQNA2001_1","PHOTOSYSTEM I P700 CHLOROPHYLL A APOPROTEIN A1","3ffu","PROBABLE PYROPHOSPHOHYDROLASE","Bdellovibrio bacteriovorus",4,"GLY A 109;TRP A 107;ALA A  79;LEU A  71","None","1.02A","6fosA-3ffuA:undetectable","6fosA-3ffuA:20.00"]]