SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4e13'

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.
1JG2_A_ADNA500_1
(PROTEIN-L-ISOASPARTA
TE
O-METHYLTRANSFERASE)		 4e13 DIKETOREDUCTASE
(Acinetobacter
baylyi) 		5 / 12 GLY A 108
ILE A 103
GLY A 134
ALA A 111
VAL A  83
 None
None
None
None
GOL  A 305 (-4.9A)
 1.20A 1jg2A-4e13A:
6.2		 1jg2A-4e13A:
24.92
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.
1MX8_A_RTLA135_0
(CELLULAR
RETINOL-BINDING
PROTEIN I, HOLO)		 4e13 DIKETOREDUCTASE
(Acinetobacter
baylyi) 		5 / 12 PHE A 258
TYR A 261
LEU A 262
ALA A 244
TYR A 281
 None
None
None
1PE  A 306 ( 4.6A)
GOL  A 304 (-4.0A)
 1.31A 1mx8A-4e13A:
undetectable		 1mx8A-4e13A:
15.90
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)		 4e13 DIKETOREDUCTASE
(Acinetobacter
baylyi) 		4 / 4 SER A 248
ILE A 247
VAL A 239
THR A 276
 1PE  A 306 (-3.1A)
1PE  A 306 ( 3.9A)
1PE  A 306 (-4.6A)
None
 1.19A 1u70A-4e13A:
undetectable		 1u70A-4e13A:
19.55
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.
1UTD_L_TRPL81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4e13 DIKETOREDUCTASE
(Acinetobacter
baylyi) 		5 / 12 HIS A  26
THR A  23
ILE A  90
GLY A 178
ALA A 154
 None
 1.01A 1utdL-4e13A:
undetectable
1utdM-4e13A:
undetectable		 1utdL-4e13A:
15.81
1utdM-4e13A:
15.81
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.
1UTD_P_TRPP81_0
(TRANSCRIPTION
ATTENUATION PROTEIN
MTRB)		 4e13 DIKETOREDUCTASE
(Acinetobacter
baylyi) 		5 / 11 HIS A  26
THR A  23
ILE A  90
GLY A 178
ALA A 154
 None
 1.03A 1utdP-4e13A:
undetectable
1utdQ-4e13A:
undetectable		 1utdP-4e13A:
15.81
1utdQ-4e13A:
15.81
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.
2FR3_A_REAA300_1
(CELLULAR RETINOIC
ACID BINDING PROTEIN
2)		 4e13 DIKETOREDUCTASE
(Acinetobacter
baylyi) 		5 / 12 PHE A 144
LEU A 142
ILE A 182
ALA A 154
TYR A  54
 None
 1.10A 2fr3A-4e13A:
undetectable		 2fr3A-4e13A:
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.
3HGG_A_CHDA211_0
(CMER)		 4e13 DIKETOREDUCTASE
(Acinetobacter
baylyi) 		4 / 7 PHE A 258
PHE A 236
SER A 248
TYR A 245
 None
None
1PE  A 306 (-3.1A)
None
 1.50A 3hggA-4e13A:
1.7		 3hggA-4e13A:
20.83
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.
4L4E_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)		 4e13 DIKETOREDUCTASE
(Acinetobacter
baylyi) 		4 / 8 PHE A 117
THR A 115
LEU A  79
VAL A  83
 None
None
None
GOL  A 305 (-4.9A)
 1.14A 4l4eA-4e13A:
undetectable		 4l4eA-4e13A:
19.00
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.
4L4F_A_CAMA503_0
(CAMPHOR
5-MONOOXYGENASE)		 4e13 DIKETOREDUCTASE
(Acinetobacter
baylyi) 		4 / 8 PHE A 117
THR A 115
LEU A  79
VAL A  83
 None
None
None
GOL  A 305 (-4.9A)
 1.16A 4l4fA-4e13A:
undetectable		 4l4fA-4e13A:
19.00
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.
5MUG_A_VIVA301_1
(ALPHA-TOCOPHEROL
TRANSFER PROTEIN)		 4e13 DIKETOREDUCTASE
(Acinetobacter
baylyi) 		3 / 3 SER A 248
SER A 251
PHE A 236
 1PE  A 306 (-3.1A)
1PE  A 306 ( 4.9A)
None
 0.90A 5mugA-4e13A:
undetectable		 5mugA-4e13A:
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.
5VCY_A_DB8A401_2
(MEMBRANE-ASSOCIATED
TYROSINE- AND
THREONINE-SPECIFIC
CDC2-INHIBITORY
KINASE)		 4e13 DIKETOREDUCTASE
(Acinetobacter
baylyi) 		4 / 4 VAL A  89
LEU A 110
ASN A   6
ASP A  87
 None
None
GOL  A 305 ( 4.7A)
None
 1.30A 5vcyA-4e13A:
undetectable		 5vcyA-4e13A:
22.63
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.
6MB5_A_NMYA301_0
(AAC(3)-IIIB PROTEIN)		 4e13 DIKETOREDUCTASE
(Acinetobacter
baylyi) 		5 / 11 ASP A 137
THR A 115
THR A 133
GLY A 134
GLU A 109
 None
 1.42A 6mb5A-4e13A:
undetectable		 6mb5A-4e13A:
17.78