SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4w9u'

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.
1KF6_N_ACTN803_0
(FUMARATE REDUCTASE
FLAVOPROTEIN
FUMARATE REDUCTASE
IRON-SULFUR PROTEIN)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		4 / 6 GLY A 313
ASP A 317
TYR A 254
TRP A 258
 None
 0.98A 1kf6M-4w9uA:
undetectable
1kf6N-4w9uA:
undetectable		 1kf6M-4w9uA:
21.04
1kf6N-4w9uA:
22.37
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.
2G70_A_SAMA2001_1
(PHENYLETHANOLAMINE
N-METHYLTRANSFERASE)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		4 / 7 TYR A  82
TYR A  79
GLY A  65
THR A  67
 None
 0.92A 2g70A-4w9uA:
undetectable		 2g70A-4w9uA:
21.36
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.
2PGZ_D_COCD401_1
(SOLUBLE
ACETYLCHOLINE
RECEPTOR)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		4 / 6 TYR A  82
TYR A 109
TYR A 254
ILE A 326
 None
 1.35A 2pgzD-4w9uA:
undetectable
2pgzE-4w9uA:
undetectable		 2pgzD-4w9uA:
23.06
2pgzE-4w9uA:
23.06
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.
2PLW_A_SAMA203_0
(RIBOSOMAL RNA
METHYLTRANSFERASE,
PUTATIVE)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		5 / 12 ALA A  33
GLY A 262
ILE A 340
ALA A 263
LEU A 366
 None
 1.10A 2plwA-4w9uA:
undetectable		 2plwA-4w9uA:
17.99
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.
2XF3_A_J01A500_1
(ORF12)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		5 / 10 VAL A 329
LEU A 261
ARG A  87
GLY A 259
ALA A  86
 None
 1.21A 2xf3A-4w9uA:
undetectable		 2xf3A-4w9uA:
23.37
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.
2XFS_A_J01A500_1
(ORF12)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		4 / 8 VAL A 312
ARG A  87
GLY A 259
ALA A  86
 None
 0.76A 2xfsA-4w9uA:
undetectable		 2xfsA-4w9uA:
23.76
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.
2XH9_A_J01A1436_1
(ORF12)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		4 / 8 VAL A 312
ARG A  87
GLY A 259
ALA A  86
 None
 0.73A 2xh9A-4w9uA:
undetectable		 2xh9A-4w9uA:
23.37
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.
3FL9_C_TOPC200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		5 / 11 GLU A  22
LEU A  84
VAL A  80
ILE A 306
THR A  19
 None
 1.31A 3fl9C-4w9uA:
undetectable		 3fl9C-4w9uA:
16.84
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.
3FL9_H_TOPH200_1
(DIHYDROFOLATE
REDUCTASE (DHFR))		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		5 / 9 GLU A  22
LEU A  84
VAL A  80
ILE A 306
THR A  19
 None
 1.27A 3fl9H-4w9uA:
undetectable		 3fl9H-4w9uA:
16.84
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.
5EML_A_SAMA701_0
(PROTEIN ARGININE
N-METHYLTRANSFERASE
5)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		5 / 12 LEU A 310
GLY A 259
ASN A 333
GLU A  88
LEU A  84
 None
 1.45A 5emlA-4w9uA:
undetectable		 5emlA-4w9uA:
20.46
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.
5N8J_E_DVAE7_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		3 / 3 TYR A 114
SER A 240
TRP A 182
 None
 0.87A 5n8jB-4w9uA:
undetectable		 5n8jB-4w9uA:
19.89
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.
5N8J_O_DVAO7_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		3 / 3 TYR A 114
SER A 240
TRP A 182
 None
 0.80A 5n8jA-4w9uA:
undetectable		 5n8jA-4w9uA:
19.89
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.
5N8J_P_DVAP5_0
(GLY-DTY-GLY-DLE-DAL-
DSG-DVA-DAS-DGL-DSN-
DSN-GLY
STREPTAVIDIN)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		3 / 3 TYR A 114
SER A 240
TRP A 182
 None
 0.74A 5n8jD-4w9uA:
undetectable		 5n8jD-4w9uA:
19.89
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.
5O4Y_A_CCSA14_0
(PHE-MAA-ASN-PRO-HIS-
LEU-SER-TRP-SER-TRP-
9KK-9KK-ARG-CCS-GLY-
NH2)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		4 / 6 PHE A 269
LEU A 295
TRP A 268
ARG A 270
 EDO  A 402 ( 3.9A)
None
None
None
 1.10A 5o4yA-4w9uA:
undetectable		 5o4yA-4w9uA:
3.32
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.
6BNI_B_ADNB602_1
(LYSINE--TRNA LIGASE)		 4w9u ACYL-COA
DEHYDROGENASE
(Brucella
abortus) 		5 / 10 GLU A  15
ALA A  81
GLU A  88
GLY A  83
ARG A  87
 None
 1.23A 6bniB-4w9uA:
undetectable		 6bniB-4w9uA:
11.68