Fluorine in PDB 7m0w: Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Pimasertib

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

All present enzymatic activity of Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Pimasertib:
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 Pimasertib, PDB code: 7m0w was solved by K.Li, G.Gonzalez Del-Pino, B.H.Ha, E.Park, M.J.Eck, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 43.55 / 3.09
Space group P 31 2 1
Cell size a, b, c (Å), α, β, γ (°) 117.334, 117.334, 130.004, 90, 90, 120
R / Rfree (%) 19.5 / 23.3

Other elements in 7m0w:

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

Magnesium (Mg) 2 atoms
Iodine (I) 1 atom

Fluorine Binding Sites:

The binding sites of Fluorine atom in the Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Pimasertib (pdb code 7m0w). This binding sites where shown within 5.0 Angstroms radius around Fluorine atom.
In total only one binding site of Fluorine was determined in the Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Pimasertib, PDB code: 7m0w:

Fluorine binding site 1 out of 1 in 7m0w

Go back to Fluorine Binding Sites List in 7m0w
Fluorine binding site 1 out of 1 in the Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Pimasertib


Mono view


Stereo pair view

A full contact list of Fluorine with other atoms in the F binding site number 1 of Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Pimasertib within 5.0Å range:
probe atom residue distance (Å) B Occ
B:F803

b:79.2
occ:1.00
 F08 B:QOA803 0.0 79.2 1.0
C04 B:QOA803 1.3 75.5 1.0
C03 B:QOA803 2.3 74.8 1.0
C05 B:QOA803 2.3 91.6 1.0
N09 B:QOA803 2.6 74.6 1.0
OD1 B:ASP208 3.0 88.9 1.0
C02 B:QOA803 3.6 83.8 1.0
C06 B:QOA803 3.6 88.0 1.0
CD1 B:ILE141 3.7 61.6 1.0
CG2 B:ILE141 3.8 66.4 1.0
O17 B:QOA803 3.8 84.2 1.0
NZ B:LYS97 4.0 104.2 1.0
SD B:MET143 4.0 88.2 1.0
CD B:LYS97 4.0 75.1 1.0
C01 B:QOA803 4.0 77.4 1.0
CE B:LYS97 4.1 100.2 1.0
C10 B:QOA803 4.1 75.7 1.0
CB B:ILE141 4.1 66.9 1.0
CE B:MET143 4.2 88.2 1.0
CG B:ASP208 4.2 90.5 1.0
CG1 B:ILE141 4.5 66.3 1.0
CA B:ASP208 4.6 80.4 1.0
C16 B:QOA803 4.7 84.6 1.0
N B:ASP208 4.7 81.5 1.0
C11 B:QOA803 4.9 77.3 1.0
C15 B:QOA803 4.9 80.4 1.0
CB B:LYS97 5.0 65.9 1.0

Reference:

K.Li, G.Gonzalez Del-Pino, B.H.Ha, E.Park, M.J.Eck. Crystal Structure of the Braf:MEK1 Kinases in Complex with Amppnp and Pimasertib To Be Published.
Page generated: Fri Aug 2 09:14:31 2024

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