Magnesium in PDB 6xf0: Cocrystal Structure of Human Camkii-Alpha (CAMK2A)Kinase Domain and TIAM1 in Complex with Atp

All present enzymatic activity of Cocrystal Structure of Human Camkii-Alpha (CAMK2A)Kinase Domain and TIAM1 in Complex with Atp:
2.7.11.17;

The structure of Cocrystal Structure of Human Camkii-Alpha (CAMK2A)Kinase Domain and TIAM1 in Complex with Atp, PDB code: 6xf0 was solved by C.Ozden, M.M.Stratton, S.C.Garman, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	41.91 / 2.71
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	43.492, 138.838, 154.966, 90.00, 90.00, 90.00
R / Rfree (%)	22.9 / 30.1

The binding sites of Magnesium atom in the Cocrystal Structure of Human Camkii-Alpha (CAMK2A)Kinase Domain and TIAM1 in Complex with Atp (pdb code 6xf0). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the Cocrystal Structure of Human Camkii-Alpha (CAMK2A)Kinase Domain and TIAM1 in Complex with Atp, PDB code: 6xf0:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in the Cocrystal Structure of Human Camkii-Alpha (CAMK2A)Kinase Domain and TIAM1 in Complex with Atp


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Cocrystal Structure of Human Camkii-Alpha (CAMK2A)Kinase Domain and TIAM1 in Complex with Atp within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg311 b:53.5 occ:1.00 O1B A:ATP313 2.5 83.3 1.0 O1A A:ATP313 3.1 70.0 1.0 O3G A:ATP313 3.2 65.8 1.0 OD2 A:ASP156 3.3 41.1 1.0 OD1 A:ASN140 3.7 26.4 1.0 PB A:ATP313 3.8 98.6 1.0 O2G A:ATP313 4.1 90.2 1.0 PG A:ATP313 4.1 86.5 1.0 O3A A:ATP313 4.1 84.8 1.0 PA A:ATP313 4.2 74.0 1.0 O3B A:ATP313 4.3 91.2 1.0 CG A:ASP156 4.4 37.5 1.0 O A:HOH421 4.4 20.8 1.0 CG A:ASN140 4.7 26.9 1.0 O A:HOH432 4.8 36.3 1.0 O5' A:ATP313 4.8 64.5 1.0 ND2 A:ASN140 5.0 25.0 1.0

Magnesium binding site 2 out of 2 in the Cocrystal Structure of Human Camkii-Alpha (CAMK2A)Kinase Domain and TIAM1 in Complex with Atp


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Cocrystal Structure of Human Camkii-Alpha (CAMK2A)Kinase Domain and TIAM1 in Complex with Atp within 5.0Å range: probe atom residue distance (Å) B Occ B:Mg302 b:37.8 occ:1.00 O1B B:ATP303 2.3 91.2 1.0 O3A B:ATP303 3.4 86.2 1.0 PB B:ATP303 3.4 89.0 1.0 O B:HOH408 3.5 48.0 1.0 C5' B:ATP303 4.0 61.9 1.0 O1A B:ATP303 4.3 76.9 1.0 PA B:ATP303 4.3 83.4 1.0 OD1 B:ASN140 4.3 38.9 1.0 O5' B:ATP303 4.3 67.3 1.0 O2B B:ATP303 4.4 80.3 1.0 O3B B:ATP303 4.5 0.3 1.0 O3' B:ATP303 4.6 68.4 1.0 C4' B:ATP303 4.6 68.3 1.0

C.Ozden, M.M.Stratton, S.C.Garman. Cocrystal Structure of Human Camkii-Alpha (CAMK2A)Kinase Domain and TIAM1 in Complex with Atp To Be Published.