SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '1ted'

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.
1MZ9_A_VDYA1002_2
(CARTILAGE OLIGOMERIC
MATRIX PROTEIN)		 1ted PKS18
(Mycobacterium
tuberculosis) 		3 / 3 ILE A 353
LEU A 356
VAL A 360
 ILE  A 353 ( 0.7A)
LEU  A 356 ( 0.6A)
VAL  A 360 ( 0.6A)
 0.40A 1mz9B-1tedA:
undetectable		 1mz9B-1tedA:
6.91
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.
2BM9_D_SAMD301_1
(CEPHALOSPORIN
HYDROXYLASE CMCI)		 1ted PKS18
(Mycobacterium
tuberculosis) 		3 / 3 ASP A 389
ASP A 308
ASN A 300
 ASP  A 389 ( 0.6A)
ASP  A 308 ( 0.5A)
ASN  A 300 ( 0.6A)
 0.74A 2bm9D-1tedA:
undetectable		 2bm9D-1tedA:
23.87
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.
2DDW_B_PXLB1005_1
(PYRIDOXINE KINASE)		 1ted PKS18
(Mycobacterium
tuberculosis) 		4 / 7 LEU A  88
HIS A 221
GLY A 225
ASP A 226
 LEU  A  88 ( 0.6A)
HIS  A 221 (-1.0A)
GLY  A 225 ( 0.0A)
ASP  A 226 ( 0.6A)
 0.96A 2ddwB-1tedA:
undetectable		 2ddwB-1tedA:
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.
2F7F_A_NIOA601_1
(NICOTINATE
PHOSPHORIBOSYLTRANSF
ERASE, PUTATIVE)		 1ted PKS18
(Mycobacterium
tuberculosis) 		4 / 6 PHE A 354
ARG A 343
GLY A  41
THR A  42
 PHE  A 354 ( 1.3A)
ARG  A 343 ( 0.6A)
GLY  A  41 ( 0.0A)
THR  A  42 ( 0.8A)
 1.26A 2f7fA-1tedA:
undetectable		 2f7fA-1tedA:
22.94
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.
2GJ5_A_VD3A163_1
(BETA-LACTOGLOBULIN)		 1ted PKS18
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 352
VAL A 199
LEU A 231
GLU A 357
ILE A  35
 LEU  A 352 ( 0.6A)
VAL  A 199 ( 0.6A)
LEU  A 231 ( 0.6A)
GLU  A 357 ( 0.6A)
ILE  A  35 ( 0.6A)
 1.14A 2gj5A-1tedA:
undetectable		 2gj5A-1tedA:
18.43
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.
2KOT_B_ANWB99_0
(PROTEIN S100-A13)		 1ted PKS18
(Mycobacterium
tuberculosis) 		4 / 8 ALA A 176
VAL A 383
THR A 382
PHE A 377
 ALA  A 176 ( 0.0A)
VAL  A 383 ( 0.6A)
THR  A 382 ( 0.8A)
PHE  A 377 ( 1.3A)
 1.21A 2kotB-1tedA:
0.0		 2kotB-1tedA:
12.72
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.
2NYU_B_SAMB201_1
(PUTATIVE RIBOSOMAL
RNA
METHYLTRANSFERASE 2)		 1ted PKS18
(Mycobacterium
tuberculosis) 		4 / 5 PRO A  99
ALA A 100
ASP A  89
ASP A 104
 PRO  A  99 ( 1.1A)
ALA  A 100 ( 0.0A)
ASP  A  89 ( 0.5A)
ASP  A 104 ( 0.6A)
 1.19A 2nyuB-1tedA:
undetectable		 2nyuB-1tedA:
21.73
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.
3C6G_A_VD3A701_1
(CYTOCHROME P450 2R1)		 1ted PKS18
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 231
ALA A 374
ALA A 176
VAL A 360
ILE A  35
 LEU  A 231 ( 0.6A)
ALA  A 374 ( 0.0A)
ALA  A 176 ( 0.0A)
VAL  A 360 ( 0.6A)
ILE  A  35 ( 0.6A)
 0.89A 3c6gA-1tedA:
undetectable		 3c6gA-1tedA:
21.52
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.
3CZH_B_D2VB602_1
(CYTOCHROME P450 2R1)		 1ted PKS18
(Mycobacterium
tuberculosis) 		5 / 12 LEU A 231
ALA A 374
ALA A 176
VAL A 360
ILE A  35
 LEU  A 231 ( 0.6A)
ALA  A 374 ( 0.0A)
ALA  A 176 ( 0.0A)
VAL  A 360 ( 0.6A)
ILE  A  35 ( 0.6A)
 0.82A 3czhB-1tedA:
undetectable		 3czhB-1tedA:
21.52
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.
3KO0_K_TFPK201_1
(PROTEIN S100-A4)		 1ted PKS18
(Mycobacterium
tuberculosis) 		4 / 8 GLY A 288
ILE A 304
PHE A 388
PHE A 375
 GLY  A 288 ( 0.0A)
ILE  A 304 ( 0.7A)
PHE  A 388 ( 1.3A)
PHE  A 375 ( 1.3A)
 0.95A 3ko0K-1tedA:
0.0
3ko0S-1tedA:
0.0		 3ko0K-1tedA:
11.96
3ko0S-1tedA:
11.96
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.
3QPS_A_CHDA211_0
(CMER)		 1ted PKS18
(Mycobacterium
tuberculosis) 		5 / 10 LEU A 281
ALA A 376
PHE A 377
GLY A 378
ILE A 264
 LEU  A 281 ( 0.6A)
ALA  A 376 ( 0.0A)
PHE  A 377 ( 1.3A)
GLY  A 378 ( 0.0A)
ILE  A 264 ( 0.7A)
 1.13A 3qpsA-1tedA:
undetectable		 3qpsA-1tedA:
18.05
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.
4B7Q_A_ZMRA601_2
(NEURAMINIDASE)		 1ted PKS18
(Mycobacterium
tuberculosis) 		3 / 3 ARG A 392
ARG A 393
ILE A 390
 ARG  A 392 ( 0.6A)
ARG  A 393 ( 0.6A)
ILE  A 390 ( 0.7A)
 0.93A 4b7qA-1tedA:
undetectable		 4b7qA-1tedA:
21.80
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.
4I41_A_MIXA500_2
(SERINE/THREONINE-PRO
TEIN KINASE PIM-1)		 1ted PKS18
(Mycobacterium
tuberculosis) 		4 / 4 LEU A 352
LEU A 182
GLN A 336
GLU A 357
 LEU  A 352 ( 0.6A)
LEU  A 182 ( 0.6A)
GLN  A 336 ( 0.6A)
GLU  A 357 ( 0.6A)
 1.21A 4i41A-1tedA:
undetectable		 4i41A-1tedA:
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.
4WNU_D_QDND602_1
(CYTOCHROME P450 2D6)		 1ted PKS18
(Mycobacterium
tuberculosis) 		5 / 10 GLY A 315
LEU A 352
ALA A 311
SER A 337
ALA A 334
 GLY  A 315 ( 0.0A)
LEU  A 352 ( 0.6A)
ALA  A 311 ( 0.0A)
SER  A 337 ( 0.0A)
ALA  A 334 ( 0.0A)
 1.26A 4wnuD-1tedA:
undetectable		 4wnuD-1tedA:
23.39
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.
5ECN_D_LEUD602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 1ted PKS18
(Mycobacterium
tuberculosis) 		4 / 8 ALA A 185
THR A 186
VAL A 189
VAL A 249
 ALA  A 185 ( 0.0A)
THR  A 186 ( 0.8A)
VAL  A 189 ( 0.6A)
VAL  A 249 ( 0.6A)
 0.79A 5ecnD-1tedA:
undetectable		 5ecnD-1tedA:
21.01
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.
5UUN_B_ACTB307_0
(GLUTATHIONE
S-TRANSFERASE-LIKE
PROTEIN)		 1ted PKS18
(Mycobacterium
tuberculosis) 		3 / 3 LEU A 198
ALA A 197
LEU A 125
 LEU  A 198 ( 0.6A)
ALA  A 197 ( 0.0A)
LEU  A 125 ( 0.6A)
 0.53A 5uunB-1tedA:
undetectable		 5uunB-1tedA:
21.91