Chlorine in PDB 2fo0: Organization of the SH3-SH2 Unit in Active and Inactive Forms of the C-Abl Tyrosine Kinase

All present enzymatic activity of Organization of the SH3-SH2 Unit in Active and Inactive Forms of the C-Abl Tyrosine Kinase:
2.7.1.112;

The structure of Organization of the SH3-SH2 Unit in Active and Inactive Forms of the C-Abl Tyrosine Kinase, PDB code: 2fo0 was solved by B.Nagar, O.Hantschel, M.Seeliger, J.M.Davies, W.I.Weis, G.Superti-Furga, J.Kuriyan, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	48.14 / 2.27
Space group	P 21 21 2
Cell size a, b, c (Å), α, β, γ (°)	79.688, 117.266, 60.416, 90.00, 90.00, 90.00
R / Rfree (%)	21 / 24.6

The binding sites of Chlorine atom in the Organization of the SH3-SH2 Unit in Active and Inactive Forms of the C-Abl Tyrosine Kinase (pdb code 2fo0). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Organization of the SH3-SH2 Unit in Active and Inactive Forms of the C-Abl Tyrosine Kinase, PDB code: 2fo0:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Organization of the SH3-SH2 Unit in Active and Inactive Forms of the C-Abl Tyrosine Kinase


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Organization of the SH3-SH2 Unit in Active and Inactive Forms of the C-Abl Tyrosine Kinase within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl2 b:42.9 occ:1.00 CL28 A:P162 0.0 42.9 1.0 C27 A:P162 1.7 34.9 1.0 C26 A:P162 2.7 35.0 1.0 C22 A:P162 2.8 31.7 1.0 C17 A:P162 3.2 29.4 1.0 CB A:ALA399 3.4 27.8 1.0 CA A:ALA399 3.4 28.8 1.0 N A:ASP400 3.5 33.8 1.0 C18 A:P162 3.6 29.4 1.0 C A:ALA399 3.8 31.7 1.0 O21 A:P162 3.8 31.1 1.0 OD1 A:ASP400 3.9 42.6 1.0 C16 A:P162 3.9 28.2 1.0 CD2 A:PHE401 4.0 33.8 1.0 C25 A:P162 4.1 32.5 1.0 C23 A:P162 4.1 30.6 1.0 N A:PHE401 4.2 34.4 1.0 CG2 A:VAL318 4.3 23.7 1.0 CB A:VAL318 4.4 26.1 1.0 CB A:PHE401 4.4 32.9 1.0 C A:ASP400 4.6 35.4 1.0 CA A:ASP400 4.6 36.0 1.0 C24 A:P162 4.6 30.0 1.0 N19 A:P162 4.7 29.5 1.0 O A:ALA399 4.7 32.8 1.0 CG A:PHE401 4.7 34.6 1.0 CG1 A:VAL318 4.7 24.8 1.0 CA A:PHE401 4.8 34.0 1.0 N A:ALA399 4.8 27.2 1.0 C13 A:P162 4.9 28.0 1.0 CG A:ASP400 4.9 41.7 1.0 CE2 A:PHE401 5.0 32.1 1.0

Chlorine binding site 2 out of 2 in the Organization of the SH3-SH2 Unit in Active and Inactive Forms of the C-Abl Tyrosine Kinase


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Organization of the SH3-SH2 Unit in Active and Inactive Forms of the C-Abl Tyrosine Kinase within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl2 b:31.1 occ:1.00 CL29 A:P162 0.0 31.1 1.0 C23 A:P162 1.8 30.6 1.0 C24 A:P162 2.7 30.0 1.0 C22 A:P162 2.8 31.7 1.0 C17 A:P162 3.1 29.4 1.0 C16 A:P162 3.6 28.2 1.0 N A:LYS290 3.6 33.0 1.0 CG1 A:VAL275 3.7 32.1 1.0 CB A:LYS290 3.7 36.1 1.0 OG1 A:THR334 3.8 26.3 1.0 CB A:ALA288 3.8 26.8 1.0 C18 A:P162 3.9 29.4 1.0 C A:ALA288 3.9 29.2 1.0 C A:VAL289 3.9 31.2 1.0 N A:VAL289 4.0 29.5 1.0 O A:ALA288 4.0 31.1 1.0 O A:ILE332 4.0 34.6 1.0 C25 A:P162 4.0 32.5 1.0 C27 A:P162 4.1 34.9 1.0 CG2 A:THR334 4.2 27.6 1.0 CA A:VAL289 4.2 30.9 1.0 CA A:LYS290 4.2 36.1 1.0 O21 A:P162 4.3 31.1 1.0 CG2 A:VAL275 4.5 28.4 1.0 CA A:ALA288 4.5 29.3 1.0 C13 A:P162 4.6 28.0 1.0 O A:VAL289 4.6 30.7 1.0 C26 A:P162 4.6 35.0 1.0 CB A:THR334 4.6 26.8 1.0 CB A:VAL275 4.7 30.5 1.0 N19 A:P162 4.8 29.5 1.0 N A:THR334 4.9 26.3 1.0

B.Nagar, O.Hantschel, M.Seeliger, J.M.Davies, W.I.Weis, G.Superti-Furga, J.Kuriyan. Organization of the SH3-SH2 Unit in Active and Inactive Forms of the C-Abl Tyrosine Kinase. Mol.Cell V. 21 787 2006.
ISSN: ISSN 1097-2765
PubMed: 16543148
DOI: 10.1016/J.MOLCEL.2006.01.035