SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '3r8r'

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.
2BL9_A_CP6A1240_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3r8r TRANSALDOLASE
(Bacillus
subtilis) 		5 / 12 ILE A  21
ALA A  23
MET A   1
ILE A 166
ILE A 190
 None
 1.02A 2bl9A-3r8rA:
undetectable		 2bl9A-3r8rA:
22.50
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.
2BL9_A_CP6A1240_1
(DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3r8r TRANSALDOLASE
(Bacillus
subtilis) 		5 / 12 ILE A  21
ALA A  23
MET A   1
PHE A   3
ILE A 166
 None
 1.09A 2bl9A-3r8rA:
undetectable		 2bl9A-3r8rA:
22.50
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.
3CV9_A_VDXA501_1
(CYTOCHROME P450-SU1)		 3r8r TRANSALDOLASE
(Bacillus
subtilis) 		5 / 9 LEU A 144
SER A 128
ILE A 145
ILE A 154
GLY A 156
 None
 1.28A 3cv9A-3r8rA:
undetectable		 3cv9A-3r8rA:
21.31
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.
3QG2_B_CP6B709_1
(BIFUNCTIONAL
DIHYDROFOLATE
REDUCTASE-THYMIDYLAT
E SYNTHASE)		 3r8r TRANSALDOLASE
(Bacillus
subtilis) 		5 / 11 ILE A  21
ALA A  23
MET A   1
PHE A   3
ILE A 166
 None
 1.15A 3qg2B-3r8rA:
undetectable		 3qg2B-3r8rA:
15.93
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.
4PBH_A_BEZA401_0
(TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT, PUTATIVE)		 3r8r TRANSALDOLASE
(Bacillus
subtilis) 		5 / 12 THR A  26
ALA A 164
ARG A 133
LEU A  31
PHE A 130
 GOL  A 221 ( 4.8A)
GOL  A 221 (-3.4A)
SO4  A 301 (-4.0A)
None
GOL  A 221 (-4.1A)
 1.21A 4pbhA-3r8rA:
undetectable		 4pbhA-3r8rA:
22.78
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.
4PBH_A_BEZA401_0
(TRAP DICARBOXYLATE
TRANSPORTER, DCTP
SUBUNIT, PUTATIVE)		 3r8r TRANSALDOLASE
(Bacillus
subtilis) 		5 / 12 THR A  26
THR A 108
ALA A 164
ARG A 133
PHE A 130
 GOL  A 221 ( 4.8A)
None
GOL  A 221 (-3.4A)
SO4  A 301 (-4.0A)
GOL  A 221 (-4.1A)
 1.07A 4pbhA-3r8rA:
undetectable		 4pbhA-3r8rA:
22.78
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.
4UCI_A_SAMA2409_0
(RNA-DIRECTED RNA
POLYMERASE L)		 3r8r TRANSALDOLASE
(Bacillus
subtilis) 		5 / 12 THR A  26
GLY A 183
GLY A  24
ALA A 175
ALA A 163
 GOL  A 221 ( 4.8A)
None
None
None
None
 1.02A 4uciA-3r8rA:
undetectable		 4uciA-3r8rA:
21.15
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.
5JNC_D_ACTD305_0
(CARBONIC ANHYDRASE 4)		 3r8r TRANSALDOLASE
(Bacillus
subtilis) 		4 / 5 ALA A 180
ALA A 163
ILE A 145
LEU A 142
 None
 0.47A 5jncD-3r8rA:
undetectable		 5jncD-3r8rA:
19.06
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.
6A94_B_ZOTB3001_0
(5-HYDROXYTRYPTAMINE
RECEPTOR 2A,SOLUBLE
CYTOCHROME B562)		 3r8r TRANSALDOLASE
(Bacillus
subtilis) 		5 / 12 THR A  82
VAL A   5
GLY A  24
SER A  54
VAL A  32
 None
 1.21A 6a94B-3r8rA:
undetectable		 6a94B-3r8rA:
22.34
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.
6DWD_A_GLYA715_0
(DEOXYNUCLEOSIDE
TRIPHOSPHATE
TRIPHOSPHOHYDROLASE
SAMHD1)		 3r8r TRANSALDOLASE
(Bacillus
subtilis) 		4 / 6 GLY A 141
ASP A 143
SER A 146
ARG A 178
 None
 1.15A 6dwdA-3r8rA:
undetectable
6dwdC-3r8rA:
undetectable		 6dwdA-3r8rA:
16.70
6dwdC-3r8rA:
16.70