Magnesium in PDB 6u2g: Braf-Mek Complex with Amp-Pcp Bound to Braf

All present enzymatic activity of Braf-Mek Complex with Amp-Pcp Bound to Braf:
2.7.11.1; 2.7.12.2;

The structure of Braf-Mek Complex with Amp-Pcp Bound to Braf, PDB code: 6u2g was solved by N.P.D.Liau, T.Wendorff, S.Hymowitz, J.Sudhamsu, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	80.16 / 2.89
Space group	P 31 2 1
Cell size a, b, c (Å), α, β, γ (°)	117.420, 117.420, 130.273, 90.00, 90.00, 120.00
R / Rfree (%)	22.9 / 27.6

The binding sites of Magnesium atom in the Braf-Mek Complex with Amp-Pcp Bound to Braf (pdb code 6u2g). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the Braf-Mek Complex with Amp-Pcp Bound to Braf, PDB code: 6u2g:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in the Braf-Mek Complex with Amp-Pcp Bound to Braf


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Braf-Mek Complex with Amp-Pcp Bound to Braf within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg902 b:55.4 occ:1.00 OD2 A:ASP208 1.7 54.5 1.0 O1A A:ACP901 2.1 52.9 1.0 O A:HOH1007 2.1 61.2 1.0 O2B A:ACP901 2.1 52.9 1.0 O A:HOH1006 2.4 54.3 1.0 OD1 A:ASN195 2.4 52.2 1.0 CG A:ASP208 2.9 53.9 1.0 PA A:ACP901 3.4 52.6 1.0 PB A:ACP901 3.5 52.6 1.0 CG A:ASN195 3.6 55.0 1.0 CB A:ASP208 3.7 50.2 1.0 O3A A:ACP901 3.8 53.7 1.0 OD1 A:ASP208 3.9 55.8 1.0 NZ A:LYS97 4.0 45.6 1.0 O A:SER194 4.1 50.8 1.0 O3G A:ACP901 4.1 63.1 1.0 ND2 A:ASN195 4.3 58.4 1.0 O5' A:ACP901 4.3 54.1 1.0 OG A:SER194 4.4 46.4 1.0 O2A A:ACP901 4.5 52.8 1.0 C A:SER194 4.5 48.9 1.0 SG A:CYS207 4.5 54.1 1.0 O1B A:ACP901 4.5 52.8 1.0 CA A:ASN195 4.6 51.5 1.0 CB A:ASN195 4.7 53.8 1.0 N A:ASN195 4.8 50.1 1.0 C3B A:ACP901 4.8 59.0 1.0 PG A:ACP901 5.0 66.7 1.0 CE A:LYS97 5.0 46.9 1.0

Magnesium binding site 2 out of 2 in the Braf-Mek Complex with Amp-Pcp Bound to Braf


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Braf-Mek Complex with Amp-Pcp Bound to Braf within 5.0Å range: probe atom residue distance (Å) B Occ B:Mg900 b:61.5 occ:1.00 OD1 B:ASN581 1.7 56.5 1.0 O2B B:ACP901 1.9 59.5 1.0 O2G B:ACP901 1.9 56.4 1.0 OD2 B:ASP594 2.2 59.9 1.0 O B:HOH1009 2.3 69.8 1.0 O1A B:ACP901 2.4 52.9 1.0 CG B:ASN581 2.8 53.8 1.0 CG B:ASP594 3.2 58.5 1.0 PB B:ACP901 3.2 52.1 1.0 PG B:ACP901 3.2 50.5 1.0 ND2 B:ASN581 3.4 52.4 1.0 PA B:ACP901 3.7 53.1 1.0 C3B B:ACP901 3.8 47.8 1.0 CB B:ASP594 3.8 54.5 1.0 O3A B:ACP901 4.0 51.5 1.0 CB B:ASN581 4.0 52.8 1.0 O1G B:ACP901 4.1 53.2 1.0 OD1 B:ASP594 4.1 62.8 1.0 CA B:ASN581 4.3 50.4 1.0 O3G B:ACP901 4.3 45.3 1.0 O B:ASN580 4.3 51.0 1.0 O1B B:ACP901 4.4 54.7 1.0 O2A B:ACP901 4.5 52.2 1.0 N B:ASN581 4.6 48.0 1.0 C B:ASN580 4.6 47.8 1.0 NZ B:LYS483 4.7 60.7 1.0 C8 B:ACP901 4.8 60.4 1.0 O5' B:ACP901 4.8 54.7 1.0 CB B:ASN580 5.0 44.2 1.0 OD2 B:ASP576 5.0 51.3 1.0

N.P.D.Liau, T.Wendorff, S.Hymowitz, J.Sudhamsu. Braf-Mek Complex with Amp-Pcp Bound to Braf To Be Published.