Chlorine in PDB 3p8z: Dengue Methyltransferase Bound to A Sam-Based Inhibitor

All present enzymatic activity of Dengue Methyltransferase Bound to A Sam-Based Inhibitor:
2.1.1.56; 2.1.1.57;

The structure of Dengue Methyltransferase Bound to A Sam-Based Inhibitor, PDB code: 3p8z was solved by C.G.Noble, L.J.Yap, J.Lescar, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	30.00 / 1.70
Space group	P 2 21 21
Cell size a, b, c (Å), α, β, γ (°)	51.811, 61.095, 184.683, 90.00, 90.00, 90.00
R / Rfree (%)	19.7 / 23.1

The binding sites of Chlorine atom in the Dengue Methyltransferase Bound to A Sam-Based Inhibitor (pdb code 3p8z). 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 Dengue Methyltransferase Bound to A Sam-Based Inhibitor, PDB code: 3p8z:

Chlorine binding site 1 out of 1 in the Dengue Methyltransferase Bound to A Sam-Based Inhibitor


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Dengue Methyltransferase Bound to A Sam-Based Inhibitor within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl263 b:28.4 occ:1.00 CL34 A:36A263 0.0 28.4 1.0 C30 A:36A263 1.8 23.6 1.0 C29 A:36A263 2.7 24.2 1.0 C31 A:36A263 2.8 24.8 1.0 CB A:MET167 3.6 16.6 1.0 O A:ARG163 3.6 14.2 1.0 CG A:MET167 3.8 15.3 1.0 C A:ARG163 3.8 15.5 1.0 CE A:MET167 3.9 17.5 1.0 N A:VAL164 3.9 12.8 1.0 CA A:VAL164 4.0 13.2 1.0 CD1 A:PHE133 4.0 26.1 1.0 C28 A:36A263 4.0 25.4 1.0 C32 A:36A263 4.0 27.1 1.0 CB A:ARG163 4.2 17.1 1.0 CB A:PHE133 4.2 18.3 1.0 CG2 A:VAL164 4.3 12.2 1.0 CA A:PHE133 4.5 17.1 1.0 C33 A:36A263 4.5 26.2 1.0 O C:HOH411 4.6 21.9 1.0 CG A:PHE133 4.6 21.7 1.0 CA A:ARG163 4.6 16.7 1.0 N A:PHE133 4.7 15.6 1.0 SD A:MET167 4.7 16.8 1.0 CB A:VAL164 4.8 12.2 1.0 CG2 A:VAL132 4.9 19.1 1.0 CG A:ARG163 4.9 21.1 1.0 NE A:ARG163 4.9 28.5 1.0 CA A:MET167 5.0 16.3 1.0 C A:VAL164 5.0 13.0 1.0

S.P.Lim, L.S.Sonntag, C.Noble, S.H.Nilar, R.H.Ng, G.Zou, P.Monaghan, K.Y.Chung, H.Dong, B.Liu, C.Bodenreider, G.Lee, M.Ding, W.L.Chan, G.Wang, Y.L.Jian, A.T.Chao, J.Lescar, Z.Yin, T.R.Vedananda, T.H.Keller, P.Y.Shi. Small Molecule Inhibitors That Selectively Block Dengue Virus Methyltransferase J.Biol.Chem. V. 286 6233 2011.
ISSN: ISSN 0021-9258
PubMed: 21147775
DOI: 10.1074/JBC.M110.179184