 |
PDBsum entry 6tfn
|
|
|
|
PDB id:
|
 |
|
 |
| Name: |
 |
Lyase
|
 |
|
Title:
|
 |
Linalool dehydratase isomerase in complex with myrcene
|
|
Structure:
|
 |
Linalool dehydratase-isomerase protein ldi. Chain: a, b, c, d, e, f, g, h, i, j. Engineered: yes
|
|
Source:
|
 |
Castellaniella defragrans 65phen. Organism_taxid: 1437824. Gene: bn940_14136. Expressed in: escherichia coli bl21(de3). Expression_system_taxid: 469008
|
|
Resolution:
|
 |
|
2.18Å
|
R-factor:
|
0.190
|
R-free:
|
0.209
|
|
|
Authors:
|
 |
A.Cuetos,E.Zukic,H.R.Danesh-Azari,G.Grogan
|
|
Key ref:
|
 |
A.Cuetos
et al.
Mutational analysis of linalool dehydratase isomerase suggests that alcohol and alkene transformations are catalyzed using noncovalent mechanisms.
Acs catalysis,
.
|
 |
|
Date:
|
 |
|
14-Nov-19
|
Release date:
|
07-Oct-20
|
|
|
|
|
|
PROCHECK
|
|
|
|
|
Headers
|
 |
|
|
References
|
|
|
|
|
|
|
E1XUJ2
(LDI_CASD6) -
Linalool dehydratase/isomerase from Castellaniella defragrans (strain DSM 12143 / CCUG 39792 / 65Phen)
|
|
|
|
Seq: Struc:
|
 |
 |
 |
397 a.a.
362 a.a.
|
|
|
|
|
|
|
|
|
 |
 |
|
|
Key: |
 |
PfamA domain |
 |
 |
 |
Secondary structure |
 |
|
|
|
|
 |
|
|
 |
 |
 |
 |
Enzyme class 1:
|
 |
E.C.4.2.1.127
- linalool dehydratase.
|
|
 |
 |
 |
 |
 |
Reaction:
|
 |
(S)-linalool = beta-myrcene + H2O
|
 |
 |
 |
 |
 |
(S)-linalool
|
=
|
beta-myrcene
Bound ligand (Het Group name = )
corresponds exactly
|
+
|
H2O
|
|
 |
 |
 |
 |
 |
 |
 |
 |
Enzyme class 2:
|
 |
E.C.5.4.4.4
- geraniol isomerase.
|
|
 |
 |
 |
 |
 |
Reaction:
|
 |
(2E)-geraniol = (S)-linalool
|
 |
 |
 |
 |
 |
Geraniol
|
=
|
linalool
Bound ligand (Het Group name = )
matches with 90.91% similarity
|
|
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
|
Note, where more than one E.C. class is given (as above), each may
correspond to a different protein domain or, in the case of polyprotein
precursors, to a different mature protein.
|
|
 |
|
Molecule diagrams generated from .mol files obtained from the
KEGG ftp site
|
|
 |
');
}
}
 |