Chlorine in PDB 2wwp: Crystal Structure of the Human Lipocalin-Type Prostaglandin D Synthase

All present enzymatic activity of Crystal Structure of the Human Lipocalin-Type Prostaglandin D Synthase:
5.3.99.2;

The structure of Crystal Structure of the Human Lipocalin-Type Prostaglandin D Synthase, PDB code: 2wwp was solved by A.K.Roos, L.Tresaugues, C.H.Arrowsmith, H.Berglund, C.Bountra, R.Collins, A.M.Edwards, S.Flodin, A.Flores, S.Graslund, M.Hammarstrom, A.Johansson, I.Johansson, A.Kallas, T.Karlberg, T.Kotyenova, A.Kotzch, P.Kraulis, N.Markova, M.Moche, T.K.Nielsen, T.Nyman, C.Persson, H.Schuler, P.Schutz, M.I.Siponen, L.Svensson, A.G.Thorsell, S.Van Den Berg, E.Wahlberg, J.Weigelt, M.Welin, M.Wisniewska, P.Nordlund, Structural Genomicsconsortium (Sgc), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	32.65 / 2.00
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	36.400, 56.590, 73.460, 90.00, 90.15, 90.00
R / Rfree (%)	20.8 / 24.6

The binding sites of Chlorine atom in the Crystal Structure of the Human Lipocalin-Type Prostaglandin D Synthase (pdb code 2wwp). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of the Human Lipocalin-Type Prostaglandin D Synthase, PDB code: 2wwp:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of the Human Lipocalin-Type Prostaglandin D Synthase


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of the Human Lipocalin-Type Prostaglandin D Synthase within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1184 b:25.4 occ:1.00 O A:HOH2003 3.5 23.0 1.0 CB A:PRO32 3.9 16.8 1.0 CB A:ASN33 3.9 14.5 1.0 N A:ASN33 4.0 14.6 1.0 C A:PRO32 4.4 15.7 1.0 CA A:ASN33 4.4 14.4 1.0 CA A:PRO32 4.5 16.6 1.0 CG A:ASN33 4.9 14.4 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of the Human Lipocalin-Type Prostaglandin D Synthase


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of the Human Lipocalin-Type Prostaglandin D Synthase within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl1185 b:24.6 occ:1.00 CD1 A:LEU159 3.6 15.7 1.0 CA A:LEU159 3.7 16.5 1.0 CE A:LYS162 3.9 16.8 1.0 CD A:LYS162 3.9 16.8 1.0 CB A:LEU159 3.9 16.3 1.0 N A:LEU159 3.9 16.3 1.0 C A:GLU158 4.2 16.6 1.0 O A:GLU158 4.3 15.9 1.0 CB A:LYS162 4.4 17.1 1.0 CD2 A:TYR128 4.4 14.3 1.0 CE2 A:TYR128 4.4 14.7 1.0 CG A:LEU159 4.4 16.1 1.0 CB A:GLU158 4.7 17.7 1.0 CG A:LYS162 4.8 17.1 1.0 CG A:TYR128 4.9 13.4 1.0 CZ A:TYR128 4.9 15.6 1.0

S.M.Lim, D.Chen, H.Teo, A.Roos, A.E.Jansson, T.Nyman, L.Tresaugues, K.Pervushin, P.Nordlund. Structural and Dynamic Insights Into Substrate Binding and Catalysis of Human Lipocalin Prostaglandin D Synthase. J.Lipid Res. V. 54 1630 2013.
ISSN: ISSN 0022-2275
PubMed: 23526831
DOI: 10.1194/JLR.M035410