 |
PDBsum entry 4e1g
|
|
|
|
 |
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
 |
|
|
|
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
|
|
|
|
|
|
|
|
|
|
Oxidoreductase
|
PDB id
|
|
|
|
4e1g
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
PDB id:
|
 |
|
 |
| Name: |
 |
Oxidoreductase
|
 |
|
Title:
|
 |
X-ray crystal structure of alpha-linolenic acid bound to the cyclooxygenase channel of cyclooxygenase-2
|
|
Structure:
|
 |
Prostaglandin g/h synthase 2. Chain: a, b. Fragment: unp residues 1-604. Synonym: cyclooxygenase-2, cox-2, glucocorticoid-regulated inflammatory cyclooxygenase, gripghs, macrophage activation- associated marker protein p71/73, pes-2, phs ii, prostaglandin h2 synthase 2, pgh synthase 2, pghs-2, prostaglandin-endoperoxide synthase 2, tis10 protein. Engineered: yes.
|
|
Source:
|
 |
Mus musculus. Mouse. Organism_taxid: 10090. Strain: wild type. Gene: cox-2, cox2, pghs-b, ptgs2, tis10. Expressed in: spodoptera frugiperda. Expression_system_taxid: 7108.
|
|
Resolution:
|
 |
|
2.10Å
|
R-factor:
|
0.161
|
R-free:
|
0.203
|
|
|
Authors:
|
 |
A.J.Vecchio,M.G.Malkowski
|
|
Key ref:
|
 |
A.J.Vecchio
et al.
(2012).
Investigating substrate promiscuity in cyclooxygenase-2: the role of Arg-120 and residues lining the hydrophobic groove.
J Biol Chem,
287,
24619-24630.
PubMed id:
|
 |
|
Date:
|
 |
|
06-Mar-12
|
Release date:
|
25-Apr-12
|
|
|
|
|
|
PROCHECK
|
|
|
|
|
Headers
|
 |
|
|
References
|
|
|
|
|
|
|
Q05769
(PGH2_MOUSE) -
Prostaglandin G/H synthase 2 from Mus musculus
|
|
|
|
Seq: Struc:
|
 |
 |
 |
604 a.a.
551 a.a.*
|
|
|
|
|
|
|
|
|
 |
 |
|
|
Key: |
 |
PfamA domain |
 |
 |
 |
Secondary structure |
 |
 |
CATH domain |
 |
|
*
PDB and UniProt seqs differ
at 2 residue positions (black
crosses)
|
|
|
|
|
 |
|
|
 |
 |
 |
 |
Enzyme class:
|
 |
E.C.1.14.99.1
- prostaglandin-endoperoxide synthase.
|
|
 |
 |
 |
 |
 |
Reaction:
|
 |
(5Z,8Z,11Z,14Z)-eicosatetraenoate + AH2 + 2 O2 = prostaglandin H2 + A + H2O
|
 |
 |
 |
 |
 |
(5Z,8Z,11Z,14Z)-eicosatetraenoate
|
+
|
AH2
|
+
|
2
×
O2
Bound ligand (Het Group name = )
matches with 50.00% similarity
|
=
|
prostaglandin H2
|
+
|
|
+
|
H2O
Bound ligand (Het Group name = )
matches with 51.11% similarity
|
|
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
|
Molecule diagrams generated from .mol files obtained from the
KEGG ftp site
|
|
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
|
|
|
| |
|
|
| |
|
|
J Biol Chem
287:24619-24630
(2012)
|
|
PubMed id:
|
|
|
|
|
| |
|
Investigating substrate promiscuity in cyclooxygenase-2: the role of Arg-120 and residues lining the hydrophobic groove.
|
|
A.J.Vecchio,
B.J.Orlando,
R.Nandagiri,
M.G.Malkowski.
|
|
|
|
| |
ABSTRACT
|
|
|
| |
|
|
|
|
|
 |
 |
|
 |
 |
 |
 |
 |
 |
 |
 |
 |
');
}
}
 |