SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '4o94'

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.
1FXV_B_PNNB1001_0
(PENICILLIN ACYLASE)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		4 / 7 MET A 260
PHE A  48
PHE A  31
ALA A  44
 None
 1.23A 1fxvA-4o94A:
undetectable
1fxvB-4o94A:
2.3		 1fxvA-4o94A:
23.21
1fxvB-4o94A:
20.43
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.
1MJQ_D_SAMD200_0
(METHIONINE REPRESSOR)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		5 / 12 ALA A  44
GLY A  42
GLU A  50
LEU A  51
ALA A 263
 None
 1.08A 1mjqC-4o94A:
undetectable
1mjqD-4o94A:
undetectable		 1mjqC-4o94A:
15.02
1mjqD-4o94A:
15.02
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.
1SBR_B_VIBB504_1
(YKOF)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		4 / 6 PRO A  90
PHE A 120
LEU A 129
ILE A 102
 None
 1.16A 1sbrA-4o94A:
undetectable
1sbrB-4o94A:
undetectable		 1sbrA-4o94A:
20.83
1sbrB-4o94A:
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.
3BWC_B_SAMB501_1
(SPERMIDINE SYNTHASE)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		4 / 5 GLN A 171
GLN A 207
ASP A 235
THR A 210
 SIN  A 403 (-3.6A)
None
None
None
 1.25A 3bwcB-4o94A:
undetectable		 3bwcB-4o94A:
25.28
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.
3P2K_C_SAMC6735_1
(16S RRNA METHYLASE)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		4 / 5 ASN A 213
ASP A 235
THR A 264
SER A 212
 SIN  A 403 (-3.3A)
None
None
None
 1.34A 3p2kC-4o94A:
undetectable		 3p2kC-4o94A:
22.19
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.
4G0V_D_MIXD101_1
(DNA TOPOISOMERASE
2-BETA)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		4 / 6 ARG A 169
GLY A 206
GLN A 179
MET A 305
 SIN  A 403 (-3.0A)
None
None
None
 0.82A 4g0vB-4o94A:
undetectable		 4g0vB-4o94A:
18.15
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.
4MF6_A_BEZA303_0
(GLUTATHIONE
S-TRANSFERASE DOMAIN)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		4 / 5 THR A  39
PRO A  40
PHE A 192
ASN A 146
 None
None
SIN  A 403 (-2.9A)
SIN  A 403 ( 4.9A)
 1.34A 4mf6A-4o94A:
undetectable		 4mf6A-4o94A:
28.36
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.
5CDN_G_EVPG2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		4 / 6 SER A 229
GLU A 228
ARG A 169
GLY A 206
 None
None
SIN  A 403 (-3.0A)
None
 0.80A 5cdnA-4o94A:
0.8
5cdnB-4o94A:
undetectable		 5cdnA-4o94A:
20.33
5cdnB-4o94A:
19.34
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.
5CDN_N_EVPN2101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT
B,DNA GYRASE SUBUNIT
B)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		4 / 6 SER A 229
GLU A 228
ARG A 169
GLY A 206
 None
None
SIN  A 403 (-3.0A)
None
 0.82A 5cdnR-4o94A:
undetectable
5cdnS-4o94A:
undetectable		 5cdnR-4o94A:
20.33
5cdnS-4o94A:
19.34
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.
5EB5_A_010A609_0
(HNL ISOENZYME 5)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		5 / 11 ALA A  52
VAL A  62
LEU A 248
VAL A  29
TRP A 245
 None
 1.22A 5eb5A-4o94A:
undetectable		 5eb5A-4o94A:
20.71
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.
5EB5_B_010B607_0
(HNL ISOENZYME 5)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		5 / 10 ALA A  52
VAL A  62
LEU A 248
VAL A  29
TRP A 245
 None
 1.21A 5eb5B-4o94A:
undetectable		 5eb5B-4o94A:
20.71
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_D_CCSD14_0
(PHE-MAA-ASN-PRO-HIS-
LEU-SER-TRP-SER-TRP-
9KK-9KK-ARG-CCS-GLY-
NH2
PROGRAMMED CELL
DEATH 1 LIGAND 1)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		5 / 12 PHE A 105
LEU A 107
SER A  93
GLY A 232
VAL A 233
 None
 1.35A 5o4yD-4o94A:
undetectable
5o4yE-4o94A:
undetectable		 5o4yD-4o94A:
3.88
5o4yE-4o94A:
16.01
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.
6DRY_A_H8DA2001_0
(5HT2B RECEPTOR, BRIL
CHIMERA)		 4o94 TRAP DICARBOXYLATE
TRANSPORTER DCTP
SUBUNIT
(Rhodopseudomonas
palustris) 		5 / 11 VAL A  60
THR A  56
VAL A  85
ALA A 255
PHE A  48
 None
 1.15A 6dryA-4o94A:
undetectable		 6dryA-4o94A:
21.36