SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '5upr'

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.
1GXS_A_BEZA601_0
(P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
A
P-(S)-HYDROXYMANDELO
NITRILE LYASE CHAIN
B)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		4 / 7 GLY A 249
PRO A 290
HIS A 309
ALA A 305
 None
 0.96A 1gxsA-5uprA:
undetectable
1gxsB-5uprA:
undetectable		 1gxsA-5uprA:
18.71
1gxsB-5uprA:
20.00
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.
1ZQ9_B_SAMB4001_0
(PROBABLE
DIMETHYLADENOSINE
TRANSFERASE)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		5 / 12 GLY A 249
LEU A 264
VAL A 271
LEU A 246
ILE A 284
 None
 0.95A 1zq9B-5uprA:
2.5		 1zq9B-5uprA:
20.79
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.
2BJF_A_DXCA330_0
(CHOLOYLGLYCINE
HYDROLASE)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		5 / 12 PHE A 121
ALA A 327
ILE A 331
ILE A 245
LEU A 316
 None
 1.02A 2bjfA-5uprA:
undetectable		 2bjfA-5uprA:
19.53
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.
2HRE_B_CHDB701_0
(FERROCHELATASE)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		3 / 3 LYS A 233
GLY A 224
PRO A 223
 None
 0.95A 2hreB-5uprA:
undetectable		 2hreB-5uprA:
22.58
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.
2RLC_A_CHDA332_0
(CHOLOYLGLYCINE
HYDROLASE)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		5 / 12 PHE A 121
ALA A 327
ILE A 331
ILE A 245
LEU A 316
 None
 0.95A 2rlcA-5uprA:
undetectable		 2rlcA-5uprA:
19.59
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.
2X1L_A_ADNA601_1
(METHIONYL-TRNA
SYNTHETASE)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		5 / 11 ALA A 287
GLY A 356
GLU A 289
ILE A 245
HIS A 212
 None
SO4  A 401 (-3.3A)
CL  A 403 (-3.0A)
None
CL  A 403 (-4.4A)
 1.09A 2x1lA-5uprA:
2.3		 2x1lA-5uprA:
19.05
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.
2X1L_C_ADNC601_1
(METHIONYL-TRNA
SYNTHETASE)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		5 / 11 ALA A 287
GLY A 356
GLU A 289
ILE A 245
HIS A 212
 None
SO4  A 401 (-3.3A)
CL  A 403 (-3.0A)
None
CL  A 403 (-4.4A)
 1.10A 2x1lC-5uprA:
undetectable		 2x1lC-5uprA:
19.05
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.
3E22_B_LOCB700_2
(TUBULIN BETA-2B
CHAIN)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		5 / 11 LEU A 210
LEU A 238
ALA A 237
ALA A 274
VAL A 271
 None
 1.14A 3e22B-5uprA:
undetectable		 3e22B-5uprA:
20.44
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.
3E22_D_LOCD700_2
(TUBULIN BETA-2B
CHAIN)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		5 / 11 LEU A 210
LEU A 238
ALA A 237
ALA A 274
VAL A 271
 None
 1.14A 3e22D-5uprA:
undetectable		 3e22D-5uprA:
20.44
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.
3SUE_D_SUED1201_1
(NS3 PROTEASE, NS4A
PROTEIN)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		5 / 12 PHE A 121
GLY A 123
GLY A 120
PHE A 345
ALA A 370
 None
 1.27A 3sueD-5uprA:
undetectable		 3sueD-5uprA:
21.66
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.
3UCB_A_017A201_2
(PROTEASE)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		5 / 12 ALA A 280
ASP A 279
VAL A 324
VAL A 271
VAL A 275
 None
 0.99A 3ucbB-5uprA:
undetectable		 3ucbB-5uprA:
18.04
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.
5G5G_C_ACTC1740_0
(PUTATIVE XANTHINE
DEHYDROGENASE YAGS
FAD-BINDING SUBUNIT)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		4 / 4 VAL A 230
GLU A 225
GLY A 211
LEU A 210
 None
 1.06A 5g5gC-5uprA:
0.1		 5g5gC-5uprA:
16.97
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.
5JH7_B_6K9B503_0
(TUBULIN BETA-2B
CHAIN)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		5 / 11 VAL A 336
SER A 335
THR A 296
TYR A 332
LEU A 344
 None
SO4  A 401 (-3.7A)
None
None
None
 1.47A 5jh7B-5uprA:
undetectable		 5jh7B-5uprA:
20.67
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.
5JH7_D_6K9D502_0
(TUBULIN BETA-2B
CHAIN)		 5upr TRIOSEPHOSPHATE
ISOMERASE
(Toxoplasma
gondii) 		5 / 11 VAL A 336
SER A 335
THR A 296
TYR A 332
LEU A 344
 None
SO4  A 401 (-3.7A)
None
None
None
 1.45A 5jh7D-5uprA:
undetectable		 5jh7D-5uprA:
20.67