SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2nuu'

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.	2Q6F_C_010C6_0 (INFECTIOUS BRONCHITIS VIRUS (IBV) MAIN PROTEASE N-[(5-METHYLISOXAZOL -3-YL)CARBONYL]ALANY L-L-VALYL-N~1~-((1R, 2Z)-4-(BENZYLOXY)-4- OXO-1-{[(3R)-2-OXOPY RROLIDIN-3-YL]METHYL }BUT-2-ENYL)-L-LEUCI NAMIDE)	2nuu	NITROGEN REGULATORY PROTEIN P-II 2 (Escherichia coli)	3 / 3	ASN G 54 LEU G 56 HIS G 42	None	0.85A	2q6fB-2nuuG: undetectable	2q6fB-2nuuG: 17.69
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.	4Y8W_C_STRC603_1 (CYTOCHROME P450 21-HYDROXYLASE)	2nuu	NITROGEN REGULATORY PROTEIN P-II 2 (Escherichia coli)	5 / 12	VAL G 73 VAL G 93 ILE G 74 VAL G 99 LEU G 112	None None None None ADP G1200 ( 4.2A)	0.88A	4y8wC-2nuuG: undetectable	4y8wC-2nuuG: 12.50
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.	5FPD_A_PZAA1385_0 (HEAT SHOCK-RELATED 70KDA PROTEIN 2)	2nuu	NITROGEN REGULATORY PROTEIN P-II 2 (Escherichia coli)	4 / 7	VAL G 77 SER G 78 ALA G 81 GLY G 89	None None None ADP G1400 (-3.9A)	0.71A	5fpdA-2nuuG: undetectable	5fpdA-2nuuG: 18.32
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.	5FPD_A_PZAA1385_0 (HEAT SHOCK-RELATED 70KDA PROTEIN 2)	2nuu	NITROGEN REGULATORY PROTEIN P-II 2 (Escherichia coli)	4 / 7	VAL G 77 SER G 78 ALA G 81 VAL G 6	None	0.89A	5fpdA-2nuuG: undetectable	5fpdA-2nuuG: 18.32
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.	5FPD_B_PZAB1385_0 (HEAT SHOCK-RELATED 70KDA PROTEIN 2)	2nuu	NITROGEN REGULATORY PROTEIN P-II 2 (Escherichia coli)	4 / 7	VAL G 77 SER G 78 ALA G 81 GLY G 89	None None None ADP G1400 (-3.9A)	0.71A	5fpdB-2nuuG: undetectable	5fpdB-2nuuG: 18.32
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.	5FPD_B_PZAB1385_0 (HEAT SHOCK-RELATED 70KDA PROTEIN 2)	2nuu	NITROGEN REGULATORY PROTEIN P-II 2 (Escherichia coli)	4 / 7	VAL G 77 SER G 78 ALA G 81 VAL G 6	None	0.88A	5fpdB-2nuuG: undetectable	5fpdB-2nuuG: 18.32

[["DrReposER ID","Desc.","Hit PDB","Hit molecule","Hit organism","Res. no.","Interface","HETATM","RMSD","Z-score","Seq ID"],["2Q6F_C_010C6_0","INFECTIOUS BRONCHITIS VIRUS (IBV) MAIN PROTEASE;N-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL-L-VALYL-N~1~-((1R,2Z)-4-(BENZYLOXY)-4-OXO-1-{[(3R)-2-OXOPYRROLIDIN-3-YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE","2nuu","NITROGEN REGULATORY PROTEIN P-II 2","Escherichia coli",3,"ASN G  54;LEU G  56;HIS G  42","None","0.85A","2q6fB-2nuuG:undetectable","2q6fB-2nuuG:17.69"],["4Y8W_C_STRC603_1","CYTOCHROME P450 21-HYDROXYLASE","2nuu","NITROGEN REGULATORY PROTEIN P-II 2","Escherichia coli",5,"VAL G  73;VAL G  93;ILE G  74;VAL G  99;LEU G 112","None;None;None;None;ADP G1200 ( 4.2A)","0.88A","4y8wC-2nuuG:undetectable","4y8wC-2nuuG:12.50"],["5FPD_A_PZAA1385_0","HEAT SHOCK-RELATED 70KDA PROTEIN 2","2nuu","NITROGEN REGULATORY PROTEIN P-II 2","Escherichia coli",4,"VAL G  77;SER G  78;ALA G  81;GLY G  89","None;None;None;ADP G1400 (-3.9A)","0.71A","5fpdA-2nuuG:undetectable","5fpdA-2nuuG:18.32"],["5FPD_A_PZAA1385_0","HEAT SHOCK-RELATED 70KDA PROTEIN 2","2nuu","NITROGEN REGULATORY PROTEIN P-II 2","Escherichia coli",4,"VAL G  77;SER G  78;ALA G  81;VAL G   6","None","0.89A","5fpdA-2nuuG:undetectable","5fpdA-2nuuG:18.32"],["5FPD_B_PZAB1385_0","HEAT SHOCK-RELATED 70KDA PROTEIN 2","2nuu","NITROGEN REGULATORY PROTEIN P-II 2","Escherichia coli",4,"VAL G  77;SER G  78;ALA G  81;GLY G  89","None;None;None;ADP G1400 (-3.9A)","0.71A","5fpdB-2nuuG:undetectable","5fpdB-2nuuG:18.32"],["5FPD_B_PZAB1385_0","HEAT SHOCK-RELATED 70KDA PROTEIN 2","2nuu","NITROGEN REGULATORY PROTEIN P-II 2","Escherichia coli",4,"VAL G  77;SER G  78;ALA G  81;VAL G   6","None","0.88A","5fpdB-2nuuG:undetectable","5fpdB-2nuuG:18.32"]]