Manganese in PDB 2a9i: Molecular Structure of the Interleukin-1 Receptor- Associated Kinase-4 Death Domain

All present enzymatic activity of Molecular Structure of the Interleukin-1 Receptor- Associated Kinase-4 Death Domain:
2.7.1.37;

The structure of Molecular Structure of the Interleukin-1 Receptor- Associated Kinase-4 Death Domain, PDB code: 2a9i was solved by M.V.Lasker, M.M.Gajjar, S.K.Nair, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	18.00 / 1.70
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	76.152, 38.043, 51.588, 90.00, 121.07, 90.00
R / Rfree (%)	17.7 / 22.3

The binding sites of Manganese atom in the Molecular Structure of the Interleukin-1 Receptor- Associated Kinase-4 Death Domain (pdb code 2a9i). This binding sites where shown within 5.0 Angstroms radius around Manganese atom.
In total only one binding site of Manganese was determined in the Molecular Structure of the Interleukin-1 Receptor- Associated Kinase-4 Death Domain, PDB code: 2a9i:

Manganese binding site 1 out of 1 in the Molecular Structure of the Interleukin-1 Receptor- Associated Kinase-4 Death Domain


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of Molecular Structure of the Interleukin-1 Receptor- Associated Kinase-4 Death Domain within 5.0Å range: probe atom residue distance (Å) B Occ A:Mn114 b:29.9 occ:1.00 CE A:LYS21 1.6 22.7 1.0 NZ A:LYS21 2.1 34.2 1.0 CD A:LYS21 2.6 20.6 1.0 OD2 A:ASP24 2.7 20.4 1.0 O A:HOH135 2.8 29.9 1.0 CG A:ASP24 3.8 21.8 1.0 CG A:LYS21 4.0 20.2 1.0 O A:HOH169 4.0 33.4 1.0 CB A:ASP24 4.2 19.5 1.0 O A:HOH230 4.4 50.2 1.0 CB A:LYS21 4.5 19.4 1.0 CA A:LYS21 4.6 19.2 1.0 O A:HOH202 4.8 55.4 1.0 OD1 A:ASP24 4.9 20.0 1.0 O A:HOH148 4.9 30.7 1.0

M.V.Lasker, M.M.Gajjar, S.K.Nair. Cutting Edge: Molecular Structure of the Il-1R-Associated Kinase-4 Death Domain and Its Implications For Tlr Signaling. J.Immunol. V. 175 4175 2005.
ISSN: ISSN 0022-1767
PubMed: 16177054