Bromine in PDB 4g55: Clathrin Terminal Domain Complexed with Pitstop 2

The structure of Clathrin Terminal Domain Complexed with Pitstop 2, PDB code: 4g55 was solved by H.Bulut, L.Von Kleist, W.Saenger, V.Haucke, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	33.74 / 1.69
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	70.899, 74.019, 82.118, 90.00, 90.00, 90.00
R / Rfree (%)	17.2 / 21.5

The binding sites of Bromine atom in the Clathrin Terminal Domain Complexed with Pitstop 2 (pdb code 4g55). This binding sites where shown within 5.0 Angstroms radius around Bromine atom.
In total only one binding site of Bromine was determined in the Clathrin Terminal Domain Complexed with Pitstop 2, PDB code: 4g55:

Bromine binding site 1 out of 1 in the Clathrin Terminal Domain Complexed with Pitstop 2


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Clathrin Terminal Domain Complexed with Pitstop 2 within 5.0Å range: probe atom residue distance (Å) B Occ A:Br418 b:35.9 occ:0.80 BR A:VH2418 0.0 35.9 0.8 CAT A:VH2418 2.0 23.1 0.8 CAJ A:VH2418 2.9 24.6 0.8 CAI A:VH2418 2.9 23.4 0.8 CE A:LYS98 3.7 16.6 0.5 NZ A:LYS98 3.7 19.8 0.5 CG A:LYS98 3.8 14.1 0.5 O A:HOH654 4.0 11.0 1.0 CD A:LYS98 4.1 16.3 0.5 CAM A:VH2418 4.2 25.8 0.8 CAL A:VH2418 4.2 24.9 0.8 CE1 A:PHE91 4.4 14.9 1.0 CAU A:VH2418 4.7 25.1 0.8 O A:DMS403 4.8 47.9 1.0 N A:LYS98 4.9 11.9 0.5 N A:LYS98 4.9 11.4 0.5 O A:HOH653 4.9 25.6 1.0 O A:LYS96 5.0 15.9 0.5 CB A:LYS98 5.0 14.2 0.5

L.Von Kleist, W.Stahlschmidt, H.Bulut, K.Gromova, D.Puchkov, M.J.Robertson, K.A.Macgregor, N.Tomilin, N.Tomlin, A.Pechstein, N.Chau, M.Chircop, J.Sakoff, J.P.Von Kries, W.Saenger, H.G.Krausslich, O.Shupliakov, P.J.Robinson, A.Mccluskey, V.Haucke. Role of the Clathrin Terminal Domain in Regulating Coated Pit Dynamics Revealed By Small Molecule Inhibition. Cell(Cambridge,Mass.) V. 146 471 2011.
ISSN: ISSN 0092-8674
PubMed: 21816279
DOI: 10.1016/J.CELL.2011.06.025