Magnesium in PDB 1jkk: 2.4A X-Ray Structure of Ternary Complex of A Catalytic Domain of Death-Associated Protein Kinase with Atp Analogue and Mg.

The structure of 2.4A X-Ray Structure of Ternary Complex of A Catalytic Domain of Death-Associated Protein Kinase with Atp Analogue and Mg., PDB code: 1jkk was solved by V.Tereshko, M.Teplova, J.Brunzelle, D.M.Watterson, M.Egli, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	19.59 / 2.40
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	46.630, 62.430, 88.670, 90.00, 90.00, 90.00
R / Rfree (%)	20.4 / 23.9

The binding sites of Magnesium atom in the 2.4A X-Ray Structure of Ternary Complex of A Catalytic Domain of Death-Associated Protein Kinase with Atp Analogue and Mg. (pdb code 1jkk). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total only one binding site of Magnesium was determined in the 2.4A X-Ray Structure of Ternary Complex of A Catalytic Domain of Death-Associated Protein Kinase with Atp Analogue and Mg., PDB code: 1jkk:

Magnesium binding site 1 out of 1 in the 2.4A X-Ray Structure of Ternary Complex of A Catalytic Domain of Death-Associated Protein Kinase with Atp Analogue and Mg.


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of 2.4A X-Ray Structure of Ternary Complex of A Catalytic Domain of Death-Associated Protein Kinase with Atp Analogue and Mg. within 5.0Å range: probe atom residue distance (Å) B Occ A:Mg510 b:69.5 occ:1.00 O2A A:ANP300 2.1 41.1 1.0 OD2 A:ASP161 2.6 22.4 1.0 OD1 A:ASN144 2.9 25.9 1.0 O2B A:ANP300 3.0 46.5 1.0 CG A:ASP161 3.2 21.1 1.0 PA A:ANP300 3.4 40.6 1.0 PB A:ANP300 3.6 47.0 1.0 O1B A:ANP300 3.7 46.4 1.0 CB A:ASP161 3.7 20.3 1.0 O3A A:ANP300 3.8 44.0 1.0 CG A:ASN144 3.8 25.2 1.0 O3' A:ANP300 4.0 33.7 1.0 OD1 A:ASP161 4.0 21.9 1.0 ND2 A:ASN144 4.1 25.1 1.0 O5' A:ANP300 4.3 39.4 1.0 C5' A:ANP300 4.3 36.7 1.0 O1A A:ANP300 4.4 41.2 1.0 OD2 A:ASP139 4.5 22.4 1.0 C3' A:ANP300 4.7 34.3 1.0

V.Tereshko, M.Teplova, J.Brunzelle, D.M.Watterson, M.Egli. Crystal Structures of the Catalytic Domain of Human Protein Kinase Associated with Apoptosis and Tumor Suppression. Nat.Struct.Biol. V. 8 899 2001.
ISSN: ISSN 1072-8368
PubMed: 11573098
DOI: 10.1038/NSB1001-899