Bromine in PDB 6v32: Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Selumetinib

Enzymatic activity of Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Selumetinib

All present enzymatic activity of Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Selumetinib:
2.7.11.1; 2.7.12.2;

Protein crystallography data

The structure of Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Selumetinib, PDB code: 6v32 was solved by K.Li, G.Gonzalez Del-Pino, E.Park, M.J.Eck, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 43.44 / 3.19
Space group P 31 2 1
Cell size a, b, c (Å), α, β, γ (°) 116.964, 116.964, 129.733, 90.00, 90.00, 120.00
R / Rfree (%) 18.9 / 23

Other elements in 6v32:

The structure of Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Selumetinib also contains other interesting chemical elements:

Fluorine (F) 1 atom
Magnesium (Mg) 2 atoms
Chlorine (Cl) 1 atom

Bromine Binding Sites:

The binding sites of Bromine atom in the Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Selumetinib (pdb code 6v32). 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 the Braf:MEK1 Kinases in Complex with Amppnp and Selumetinib, PDB code: 6v32:

Bromine binding site 1 out of 1 in 6v32

Go back to Bromine Binding Sites List in 6v32
Bromine binding site 1 out of 1 in the Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Selumetinib


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 the Braf:MEK1 Kinases in Complex with Amppnp and Selumetinib within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Br401

b:0.8
occ:0.83
 BR1 B:3EW401 0.0 0.8 0.8
C11 B:3EW401 1.9 0.3 0.8
C10 B:3EW401 2.9 0.2 0.8
C12 B:3EW401 2.9 0.9 0.8
O B:VAL127 3.4 78.9 1.0
CE1 B:PHE209 3.6 0.9 1.0
CZ B:PHE209 4.0 0.6 1.0
CB B:VAL127 4.0 68.2 1.0
CB B:CYS207 4.1 83.9 1.0
C9 B:3EW401 4.2 99.8 0.8
C B:VAL127 4.2 78.3 1.0
C13 B:3EW401 4.2 98.7 0.8
CA B:CYS207 4.4 86.9 1.0
CG2 B:ILE126 4.5 95.5 1.0
CA B:VAL127 4.5 69.6 1.0
CG1 B:VAL127 4.5 68.5 1.0
N B:VAL127 4.5 74.4 1.0
CD1 B:PHE209 4.6 0.7 1.0
O B:GLY128 4.7 91.1 1.0
C8 B:3EW401 4.7 88.4 0.8
O B:LEU206 4.8 81.3 1.0
N B:ASP208 4.9 0.8 1.0
CD2 B:LEU118 4.9 84.3 1.0
CB B:PHE129 4.9 87.0 1.0

Reference:

K.Li, G.Gonzalez Del-Pino, E.Park, M.J.Eck. Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Selumetinib To Be Published.
Page generated: Sat Dec 12 02:40:04 2020

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