SIMILAR PATTERN OF AMINO ACIDS MAPPED TO '2yyl'

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.
1DIT_P_2PPP1_1
(ALPHA-THROMBIN
PEPTIDE INHIBITOR
CVS995)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		4 / 6 LEU A  80
GLU A 342
ASP A 354
PRO A 353
 None
 1.20A 1ditH-2yylA:
undetectable
1ditP-2yylA:
undetectable		 1ditH-2yylA:
19.26
1ditP-2yylA:
4.26
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.
2AZQ_A_PCFA954_0
(CATECHOL
1,2-DIOXYGENASE)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		5 / 9 LEU A 105
GLU A 191
ALA A 189
LEU A 188
LEU A 220
 None
 1.41A 2azqA-2yylA:
1.0		 2azqA-2yylA:
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.
2D55_C_DVAC8_0
(ACTINOMYCIN D)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		3 / 3 PRO A  33
THR A  31
PRO A  29
 None
 0.74A 2d55C-2yylA:
undetectable		 2d55C-2yylA:
3.11
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.
2FK8_A_SAMA302_1
(METHOXY MYCOLIC ACID
SYNTHASE 4)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		3 / 3 SER A 101
THR A  59
GLN A  49
 None
 0.86A 2fk8A-2yylA:
undetectable		 2fk8A-2yylA:
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.
2J0D_A_ERYA1498_0
(CYTOCHROME P450 3A4)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		5 / 12 ARG A 373
ILE A 325
ALA A 307
ALA A 381
GLU A 377
 None
 1.20A 2j0dA-2yylA:
undetectable		 2j0dA-2yylA:
23.99
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.
2J0D_A_ERYA1498_0
(CYTOCHROME P450 3A4)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		5 / 12 ARG A 373
ILE A 325
ILE A 322
ALA A 307
ALA A 381
 None
 1.10A 2j0dA-2yylA:
undetectable		 2j0dA-2yylA:
23.99
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.
2WV2_A_TPFA1_1
(LANOSTEROL
14-ALPHA-DEMETHYLASE)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		5 / 9 TYR A 369
TYR A 365
ALA A 294
ALA A 298
LEU A 376
 None
 1.46A 2wv2A-2yylA:
0.0		 2wv2A-2yylA:
21.35
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.
3APX_A_Z80A190_1
(ALPHA-1-ACID
GLYCOPROTEIN 2)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		5 / 12 VAL A 109
PHE A 252
LEU A 220
GLU A 191
PHE A 211
 None
 1.23A 3apxA-2yylA:
undetectable		 3apxA-2yylA:
18.75
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.
3N8X_B_NIMB1701_1
(PROSTAGLANDIN G/H
SYNTHASE 1)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		5 / 12 LEU A 418
LEU A 387
ILE A 310
GLY A 407
LEU A 405
 None
 1.10A 3n8xB-2yylA:
0.6		 3n8xB-2yylA:
21.43
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.
3OU6_C_SAMC300_1
(SAM-DEPENDENT
METHYLTRANSFERASE)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		3 / 3 TYR A 456
GLY A 356
ASP A 354
 None
 0.55A 3ou6C-2yylA:
undetectable		 3ou6C-2yylA:
18.58
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.
3QXV_D_MTXD2000_2
(ANTI-METHOTREXATE
CDR1-4 GRAFT VHH)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		3 / 3 LEU A 452
ARG A 338
ASN A 282
 None
 0.69A 3qxvD-2yylA:
undetectable		 3qxvD-2yylA:
13.94
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.
4G10_A_ACTA301_0
(GLUTATHIONE
S-TRANSFERASE
HOMOLOG)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		4 / 6 PRO A 102
ILE A  38
TYR A  46
TYR A   8
 None
 1.19A 4g10A-2yylA:
undetectable		 4g10A-2yylA:
19.21
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.
4PST_A_FOLA201_1
(DIHYDROFOLATE
REDUCTASE)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		3 / 3 ILE A   9
ASP A  28
ARG A  40
 None
 0.59A 4pstA-2yylA:
undetectable		 4pstA-2yylA:
15.24
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.
4WCX_C_SAMC503_0
(BIOTIN AND THIAMIN
SYNTHESIS ASSOCIATED)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		5 / 12 GLY A 276
LEU A 351
PRO A  74
ALA A 339
HIS A 286
 None
 1.25A 4wcxC-2yylA:
2.3		 4wcxC-2yylA:
21.82
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.
5ECM_A_LEUA602_0
(JASMONIC ACID-AMIDO
SYNTHETASE JAR1)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		4 / 5 THR A 185
ALA A 184
THR A 183
HIS A 142
 FAD  A 600 (-3.7A)
None
FAD  A 600 (-4.1A)
FAD  A 600 (-3.5A)
 1.23A 5ecmA-2yylA:
undetectable		 5ecmA-2yylA:
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.
5H5F_A_SAMA301_0
(PROTEIN ARGININE
N-METHYLTRANSFERASE
SFM1)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		5 / 12 GLY A 443
ASP A 444
ARG A 447
LEU A 358
ALA A 285
 FAD  A 600 (-3.3A)
FAD  A 600 (-3.0A)
FAD  A 600 (-3.3A)
None
None
 0.78A 5h5fA-2yylA:
undetectable		 5h5fA-2yylA:
17.98
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.
5JHD_J_EDTJ301_0
(TCRBETA CHAIN)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		4 / 5 TYR A 207
GLU A 205
GLY A 203
SER A 156
 None
 1.39A 5jhdJ-2yylA:
undetectable		 5jhdJ-2yylA:
19.88
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.
5M10_A_NCAA603_0
(CYCLOHEXANONE
MONOOXYGENASE FROM
THERMOCRISPUM
MUNICIPALE)		 2yyl 4-HYDROXYPHENYLACETA
TE-3-HYDROXYLASE
(Thermus
thermophilus) 		4 / 5 LEU A 133
ARG A 261
PHE A 263
LEU A 193
 None
SO4  A 702 (-3.8A)
None
None
 1.30A 5m10A-2yylA:
undetectable		 5m10A-2yylA:
23.71