SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4wrr'

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 (%)		 View Dock
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.
1N2X_A_SAMA401_0
(S-ADENOSYL-METHYLTRA
NSFERASE MRAW)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 12 GLY A 202
GLU A 203
VAL A 199
ASP A 223
VAL A 215
 None
 0.96A 1n2xA-4wrrA:
2.8		 1n2xA-4wrrA:
21.53
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.
1N4H_A_REAA500_1
(NUCLEAR RECEPTOR
ROR-BETA)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 11 ILE A 118
ALA A 114
VAL A 107
ARG A 103
VAL A  74
 None
 1.25A 1n4hA-4wrrA:
undetectable		 1n4hA-4wrrA:
23.26
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.
1YKI_A_NFZA1219_1
(OXYGEN-INSENSITIVE
NAD(P)H
NITROREDUCTASE)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		4 / 8 PHE A 101
GLU A  76
GLY A  72
THR A  52
 None
 0.97A 1ykiA-4wrrA:
undetectable
1ykiB-4wrrA:
undetectable		 1ykiA-4wrrA:
21.94
1ykiB-4wrrA:
21.94
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.
2BM9_F_SAMF301_0
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 12 GLY A 202
LEU A 205
GLY A 141
CYH A 282
ALA A 131
 None
 1.04A 2bm9F-4wrrA:
2.3		 2bm9F-4wrrA:
19.48
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.
2WEY_B_EV1B1771_1
(CAMP AND
CAMP-INHIBITED CGMP
3', 5'-CYCLIC
PHOSPHODIESTERASE)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		4 / 8 LEU A 144
ILE A 239
TYR A 238
PHE A 235
 None
 0.79A 2weyB-4wrrA:
undetectable		 2weyB-4wrrA:
21.76
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.
3BOG_C_DVAC10_0
(6.5 KDA GLYCINE-RICH
ANTIFREEZE PROTEIN)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		3 / 3 GLY A 161
GLY A 206
GLY A 164
 None
 0.38A 3bogC-4wrrA:
undetectable		 3bogC-4wrrA:
13.13
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_2
(PROTEASE)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 10 LEU A  43
ALA A  51
VAL A  67
GLY A  80
ILE A  12
 None
 0.97A 3ekpB-4wrrA:
undetectable		 3ekpB-4wrrA:
16.00
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.
3EM3_B_478B200_2
(PROTEASE)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 10 LEU A  43
ALA A  51
VAL A  67
GLY A  80
ILE A  12
 None
 0.99A 3em3B-4wrrA:
undetectable		 3em3B-4wrrA:
14.33
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.
3NBQ_A_URFA400_1
(URIDINE
PHOSPHORYLASE 1)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 9 THR A 104
GLY A 106
GLN A 109
LEU A 105
ILE A  92
 None
 1.39A 3nbqA-4wrrA:
3.0		 3nbqA-4wrrA:
20.23
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.
3NUO_B_478B478_2
(PROTEASE)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 9 LEU A  43
ALA A  51
VAL A  67
GLY A  80
ILE A  12
 None
 0.95A 3nuoB-4wrrA:
undetectable		 3nuoB-4wrrA:
17.79
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.
3OXV_C_478C200_1
(HIV-1 PROTEASE)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 9 LEU A  43
ALA A  51
VAL A  67
GLY A  80
ILE A  12
 None
 0.98A 3oxvC-4wrrA:
undetectable		 3oxvC-4wrrA:
16.33
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.
3OXW_B_017B200_2
(HIV-1 PROTEASE)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 10 LEU A  43
ALA A  51
VAL A  67
GLY A  80
ILE A  12
 None
 1.02A 3oxwB-4wrrA:
undetectable		 3oxwB-4wrrA:
16.33
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.
3OXW_D_017D200_2
(HIV-1 PROTEASE)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 10 LEU A  43
ALA A  51
VAL A  67
GLY A  80
ILE A  12
 None
 0.96A 3oxwD-4wrrA:
undetectable		 3oxwD-4wrrA:
16.33
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.
3OZV_B_ECNB411_1
(FLAVOHEMOGLOBIN)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 9 ILE A 170
ILE A 239
TYR A 238
LEU A 167
LEU A 196
 None
 1.07A 3ozvB-4wrrA:
undetectable		 3ozvB-4wrrA:
22.80
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.
3W9T_B_W9TB513_1
(HEMOLYTIC LECTIN
CEL-III)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		4 / 6 CYH A  98
THR A  97
ASN A  99
ILE A 208
 None
 1.45A 3w9tB-4wrrA:
undetectable		 3w9tB-4wrrA:
21.52
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.
4NJU_A_TPVA500_2
(PROTEASE)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 10 LEU A  43
ALA A  51
VAL A  67
GLY A  80
ILE A  12
 None
 1.05A 4njuB-4wrrA:
undetectable		 4njuB-4wrrA:
16.50
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.
4NJU_C_TPVC500_2
(PROTEASE)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 10 LEU A  43
ALA A  51
VAL A  67
GLY A  80
ILE A  12
 None
 1.07A 4njuD-4wrrA:
undetectable		 4njuD-4wrrA:
16.50
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.
4XMF_A_HSMA202_1
(NITROPHORIN-7)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		3 / 3 ASP A 100
LEU A 167
GLY A 164
 None
 0.56A 4xmfA-4wrrA:
undetectable		 4xmfA-4wrrA:
22.33
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.
5KQY_B_017B101_1
(PROTEASE E35D-DRV)		 4wrr PUTATIVE
DIACYLGLYCEROL
KINASE
(Bacillus
anthracis) 		5 / 12 ALA A 257
VAL A 199
ILE A 284
VAL A 226
ILE A 224
 None
 1.08A 5kqyA-4wrrA:
undetectable		 5kqyA-4wrrA:
15.67