Chlorine in PDB 7s5l: Cembrene A Synthase From Eleutherobia Rubra

The structure of Cembrene A Synthase From Eleutherobia Rubra, PDB code: 7s5l was solved by P.Y.-T.Chen, B.S.Moore, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	37.97 / 1.58
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	85.689, 101.649, 46.342, 90, 90.6, 90
R / Rfree (%)	16.2 / 19.2

The binding sites of Chlorine atom in the Cembrene A Synthase From Eleutherobia Rubra (pdb code 7s5l). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Cembrene A Synthase From Eleutherobia Rubra, PDB code: 7s5l:

Chlorine binding site 1 out of 1 in the Cembrene A Synthase From Eleutherobia Rubra


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Cembrene A Synthase From Eleutherobia Rubra within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl401 b:27.9 occ:0.50 ND2 A:ASN112 3.3 23.9 1.0 O A:HOH624 3.3 28.8 1.0 CA A:ALA109 3.7 21.1 1.0 CB A:ASN112 4.1 22.3 1.0 CB A:ALA109 4.1 21.1 1.0 CG A:ASN112 4.2 23.9 1.0 N A:ALA109 4.3 20.4 1.0 CG2 A:ILE108 4.4 23.5 1.0 O A:ILE108 4.5 21.5 1.0 C A:ILE108 4.6 21.5 1.0 C A:ALA109 4.9 22.2 1.0 O A:ALA109 4.9 23.3 1.0

I.Burkhardt, T.De Rond, P.Y.Chen, B.S.Moore. Ancient Plant-Like Terpene Biosynthesis in Corals. Nat.Chem.Biol. V. 18 664 2022.
ISSN: ESSN 1552-4469
PubMed: 35606558
DOI: 10.1038/S41589-022-01026-2