Chlorine in PDB 2axi: HDM2 in Complex with A Beta-Hairpin

The structure of HDM2 in Complex with A Beta-Hairpin, PDB code: 2axi was solved by P.R.E.Mittl, R.Fasan, J.Robinson, M.G.Gruetter, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	10.00 / 1.40
Space group	C 2 2 21
Cell size a, b, c (Å), α, β, γ (°)	45.180, 77.749, 61.257, 90.00, 90.00, 90.00
R / Rfree (%)	14.9 / 23.4

The binding sites of Chlorine atom in the HDM2 in Complex with A Beta-Hairpin (pdb code 2axi). 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 HDM2 in Complex with A Beta-Hairpin, PDB code: 2axi:

Chlorine binding site 1 out of 1 in the HDM2 in Complex with A Beta-Hairpin


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of HDM2 in Complex with A Beta-Hairpin within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl23 b:21.1 occ:1.00 CLL B:6CW23 0.0 21.1 1.0 CH2 B:6CW23 1.7 16.8 1.0 CZ2 B:6CW23 2.6 18.4 1.0 CZ3 B:6CW23 2.6 18.0 1.0 CZ A:PHE86 3.3 24.7 0.5 CZ A:PHE86 3.4 22.2 0.5 CE2 A:PHE86 3.6 24.2 0.5 CG2 A:ILE99 3.6 20.7 1.0 CE2 A:PHE86 3.6 22.3 0.5 CZ A:PHE91 3.7 19.1 1.0 CD2 A:LEU57 3.9 18.2 0.3 CD1 A:ILE61 3.9 15.5 1.0 CE1 A:PHE91 3.9 19.1 1.0 CE2 B:6CW23 3.9 16.3 1.0 CE3 B:6CW23 3.9 16.7 1.0 CG1 A:ILE99 4.1 19.4 1.0 CG A:LEU57 4.2 17.3 0.3 CD1 A:ILE99 4.3 21.6 1.0 CE1 A:PHE86 4.3 24.6 0.5 CD2 B:6CW23 4.5 17.2 1.0 CB A:ILE99 4.5 17.5 1.0 CE1 A:PHE86 4.5 22.2 0.5 CD1 A:ILE103 4.6 24.1 1.0 CD2 A:PHE86 4.8 26.0 0.5 CD2 A:PHE86 4.9 24.6 0.5 CE2 A:PHE91 4.9 17.7 1.0 CB A:LEU57 4.9 16.0 0.3 CB A:LEU57 5.0 16.3 0.7

R.Fasan, R.L.Dias, K.Moehle, O.Zerbe, D.Obrecht, P.R.Mittl, J.A.Robinson. Structure-Activity Studies in A Family of Beta-Hairpin Protein Epitope Mimetic Inhibitors of the P53-HDM2 Protein-Protein Interaction. Chembiochem V. 7 515 2006.
ISSN: ISSN 1439-4227
PubMed: 16511824
DOI: 10.1002/CBIC.200500452