SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3grk'

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.
1U70_A_MTXA187_2
(DIHYDROFOLATE
REDUCTASE)		 3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)
(Brucella
melitensis) 		4 / 4 SER A 191
ILE A 190
VAL A 223
THR A 197
 None
 1.21A 1u70A-3grkA:
undetectable		 1u70A-3grkA:
20.33
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.
1WRL_D_TFPD207_1
(TROPONIN C, SLOW
SKELETAL AND CARDIAC
MUSCLES)		 3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)
(Brucella
melitensis) 		4 / 8 SER A 172
PHE A 116
MET A 120
SER A 123
 None
 0.88A 1wrlC-3grkA:
undetectable
1wrlD-3grkA:
undetectable		 1wrlC-3grkA:
16.38
1wrlD-3grkA:
16.38
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.
3IAZ_A_AINA1202_1
(LACTOTRANSFERRIN)		 3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)
(Brucella
melitensis) 		3 / 3 GLU A 103
GLY A 106
THR A 105
 None
 0.58A 3iazA-3grkA:
undetectable		 3iazA-3grkA:
19.44
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)		 3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)
(Brucella
melitensis) 		5 / 11 LEU A  92
ILE A  15
GLY A  17
ALA A  95
LEU A 147
 None
 1.17A 3n8yA-3grkA:
undetectable		 3n8yA-3grkA:
18.60
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.
3PHA_A_ACRA701_2
(ALPHA-GLUCOSIDASE)		 3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)
(Brucella
melitensis) 		4 / 5 PRO A 194
ILE A 195
TYR A 208
MET A 156
 None
 1.36A 3phaA-3grkA:
2.4		 3phaA-3grkA:
19.03
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.
3ZQT_A_30ZA1920_1
(ANDROGEN RECEPTOR)		 3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)
(Brucella
melitensis) 		4 / 6 GLY A 232
LEU A 145
ASN A 188
GLU A 246
 None
 0.92A 3zqtA-3grkA:
undetectable		 3zqtA-3grkA:
21.84
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.
4K87_A_ADNA602_1
(PROLINE--TRNA LIGASE)		 3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)
(Brucella
melitensis) 		4 / 8 ARG A  12
PHE A  91
GLN A   9
GLY A   6
 None
 0.92A 4k87A-3grkA:
undetectable		 4k87A-3grkA:
22.26
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.
4R3A_B_RBFB402_2
(BLUE-LIGHT-ACTIVATED
HISTIDINE KINASE 2)		 3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)
(Brucella
melitensis) 		5 / 12 ALA A  32
LEU A   8
ILE A  15
ILE A 144
GLY A 232
 None
 0.83A 4r3aB-3grkA:
undetectable		 4r3aB-3grkA:
23.32
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.
5I3C_C_AC2C301_1
(PURINE NUCLEOSIDE
PHOSPHORYLASE
DEOD-TYPE)		 3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)
(Brucella
melitensis) 		5 / 11 GLY A 229
ALA A 250
VAL A 228
GLU A 227
ILE A  28
 None
 1.15A 5i3cC-3grkA:
undetectable		 5i3cC-3grkA:
21.82
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.
5WBV_A_SAMA402_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
KMT5B)		 3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)
(Brucella
melitensis) 		5 / 12 TYR A 150
SER A 191
GLY A 253
ALA A 217
GLU A 153
 None
 1.30A 5wbvA-3grkA:
undetectable		 5wbvA-3grkA:
20.32
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.
5WBV_B_SAMB402_0
(HISTONE-LYSINE
N-METHYLTRANSFERASE
KMT5B)		 3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)
(Brucella
melitensis) 		5 / 12 TYR A 150
SER A 191
GLY A 253
ALA A 217
GLU A 153
 None
 1.30A 5wbvB-3grkA:
undetectable		 5wbvB-3grkA:
20.32
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.
6F8C_A_STRA502_1
(CYTOCHROME P450
CYP260A1)		 3grk ENOYL-(ACYL-CARRIER-
PROTEIN) REDUCTASE
(NADH)
(Brucella
melitensis) 		4 / 6 ALA A  35
GLY A 232
ILE A  15
PHE A  41
 None
 0.77A 6f8cA-3grkA:
undetectable		 6f8cA-3grkA:
17.45