Bromine in PDB 2jdz: Crystal Structure of Recombinant Dioclea Guianensis Lectin Complexed with 5-Bromo-4-Chloro-3-Indolyl-A-D-Mannose

The structure of Crystal Structure of Recombinant Dioclea Guianensis Lectin Complexed with 5-Bromo-4-Chloro-3-Indolyl-A-D-Mannose, PDB code: 2jdz was solved by C.S.Nagano, L.Sanz, B.S.Cavada, J.J.Calvete, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	34.14 / 2.10
Space group	I 41 2 2
Cell size a, b, c (Å), α, β, γ (°)	89.222, 89.222, 106.069, 90.00, 90.00, 90.00
R / Rfree (%)	19.6 / 24.9

The structure of Crystal Structure of Recombinant Dioclea Guianensis Lectin Complexed with 5-Bromo-4-Chloro-3-Indolyl-A-D-Mannose also contains other interesting chemical elements:

Manganese	(Mn)	5 atoms
Cadmium	(Cd)	1 atom
Calcium	(Ca)	1 atom
Chlorine	(Cl)	1 atom

The binding sites of Bromine atom in the Crystal Structure of Recombinant Dioclea Guianensis Lectin Complexed with 5-Bromo-4-Chloro-3-Indolyl-A-D-Mannose (pdb code 2jdz). 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 Crystal Structure of Recombinant Dioclea Guianensis Lectin Complexed with 5-Bromo-4-Chloro-3-Indolyl-A-D-Mannose, PDB code: 2jdz:

Bromine binding site 1 out of 1 in the Crystal Structure of Recombinant Dioclea Guianensis Lectin Complexed with 5-Bromo-4-Chloro-3-Indolyl-A-D-Mannose


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Crystal Structure of Recombinant Dioclea Guianensis Lectin Complexed with 5-Bromo-4-Chloro-3-Indolyl-A-D-Mannose within 5.0Å range: probe atom residue distance (Å) B Occ A:Br249 b:53.0 occ:1.00 BR A:XMM249 0.0 53.0 1.0 C13 A:XMM249 1.9 50.5 1.0 C10 A:XMM249 2.8 50.4 1.0 C14 A:XMM249 2.9 49.8 1.0 CL A:XMM249 3.1 51.6 1.0 C8 A:XMM249 4.1 49.9 1.0 C12 A:XMM249 4.1 50.3 1.0 C9 A:XMM249 4.6 50.7 1.0

C.S.Nagano, J.J.Calvete, D.Barettino, A.Perez, B.S.Cavada, L.Sanz. Insights Into the Structural Basis of the pH-Dependent Dimer-Tetramer Equilibrium Through Crystallographic Analysis of Recombinant Diocleinae Lectins. Biochem.J. V. 409 417 2008.
ISSN: ISSN 0264-6021
PubMed: 17937659
DOI: 10.1042/BJ20070942