SIMILAR PATTERN OF AMINO ACIDS MAPPED TO 'ML0'


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
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
1MMK_A_H4BA1427_1
(PHENYLALANINE-4-HYDR
OXYLASE)		 3hf8 TRYPTOPHAN
5-HYDROXYLASE 1
(Homo
sapiens) 		5 / 12 TYR A 235
GLU A 273
HIS A 277
TYR A 312
GLU A 317
 ML0  A 401 (-3.9A)
FE  A 400 ( 4.6A)
FE  A 400 (-3.2A)
None
FE  A 400 ( 1.9A)
 1.19A 1mmkA-3hf8A:
40.7		 1mmkA-3hf8A:
64.98
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.
1XVA_A_SAMA293_0
(GLYCINE
N-METHYLTRANSFERASE)		 3hf8 TRYPTOPHAN
5-HYDROXYLASE 1
(Homo
sapiens) 		5 / 12 TYR A 206
VAL A 256
ASP A 269
SER A 336
TYR A 193
 None
None
None
ML0  A 401 (-2.6A)
None
 1.45A 1xvaA-3hf8A:
undetectable		 1xvaA-3hf8A:
21.23
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.
2HDN_D_TACD2888_1
(ELONGATION FACTOR
EF-TU)		 3hf8 TRYPTOPHAN
5-HYDROXYLASE 1
(Homo
sapiens) 		4 / 5 SER A 339
THR A 265
SER A 337
PRO A 262
 None
ML0  A 401 (-4.4A)
ML0  A 401 (-4.0A)
None
 1.38A 2hdnB-3hf8A:
undetectable
2hdnC-3hf8A:
undetectable
2hdnD-3hf8A:
undetectable		 2hdnB-3hf8A:
20.80
2hdnC-3hf8A:
8.80
2hdnD-3hf8A:
20.80
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.
4KTT_C_SAMC404_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3hf8 TRYPTOPHAN
5-HYDROXYLASE 1
(Homo
sapiens) 		4 / 8 HIS A 272
PRO A 268
SER A 290
PHE A 250
 FE  A 400 ( 3.3A)
ML0  A 401 (-3.6A)
None
None
 1.23A 4kttC-3hf8A:
undetectable		 4kttC-3hf8A:
20.10
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.
4NDN_C_SAMC405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3hf8 TRYPTOPHAN
5-HYDROXYLASE 1
(Homo
sapiens) 		4 / 7 HIS A 272
PRO A 268
SER A 290
PHE A 250
 FE  A 400 ( 3.3A)
ML0  A 401 (-3.6A)
None
None
 1.25A 4ndnC-3hf8A:
undetectable		 4ndnC-3hf8A:
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.
4R7L_A_SHHA709_1
(LEUKOTRIENE A-4
HYDROLASE)		 3hf8 TRYPTOPHAN
5-HYDROXYLASE 1
(Homo
sapiens) 		5 / 12 TYR A 235
HIS A 272
GLU A 273
HIS A 277
GLU A 317
 ML0  A 401 (-3.9A)
FE  A 400 ( 3.3A)
FE  A 400 ( 4.6A)
FE  A 400 (-3.2A)
FE  A 400 ( 1.9A)
 1.27A 4r7lA-3hf8A:
undetectable		 4r7lA-3hf8A:
18.44
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.
4Z2E_H_TR6H101_1
(DNA GYRASE SUBUNIT A
DNA GYRASE SUBUNIT B
SYMMETRIZED E-SITE
DNA)		 3hf8 TRYPTOPHAN
5-HYDROXYLASE 1
(Homo
sapiens) 		3 / 5 GLY A 276
GLY A 333
GLU A 317
 None
ML0  A 401 (-3.9A)
FE  A 400 ( 1.9A)
 0.46A 4z2eA-3hf8A:
undetectable
4z2eD-3hf8A:
undetectable		 4z2eA-3hf8A:
20.39
4z2eD-3hf8A:
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.
5A1I_A_SAMA405_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3hf8 TRYPTOPHAN
5-HYDROXYLASE 1
(Homo
sapiens) 		4 / 7 HIS A 272
PRO A 268
SER A 290
PHE A 250
 FE  A 400 ( 3.3A)
ML0  A 401 (-3.6A)
None
None
 1.31A 5a1iA-3hf8A:
undetectable		 5a1iA-3hf8A:
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.
6G6R_A_SAMA406_0
(S-ADENOSYLMETHIONINE
SYNTHASE ISOFORM
TYPE-2)		 3hf8 TRYPTOPHAN
5-HYDROXYLASE 1
(Homo
sapiens) 		4 / 7 HIS A 272
PRO A 268
SER A 290
PHE A 250
 FE  A 400 ( 3.3A)
ML0  A 401 (-3.6A)
None
None
 1.30A 6g6rA-3hf8A:
undetectable		 6g6rA-3hf8A:
21.35
Available target for annotated drug, i.e. matched protein structure has more than 30% sequence identity to known drug target.
6PAH_A_DAHA600_1
(PHENYLALANINE
4-MONOOXYGENASE)		 3hf8 TRYPTOPHAN
5-HYDROXYLASE 1
(Homo
sapiens) 		5 / 6 PRO A 268
HIS A 272
HIS A 277
TYR A 312
GLU A 317
 ML0  A 401 (-3.6A)
FE  A 400 ( 3.3A)
FE  A 400 (-3.2A)
None
FE  A 400 ( 1.9A)
 0.65A 6pahA-3hf8A:
41.7		 6pahA-3hf8A:
66.21