Iodine in PDB 4iwp: Crystal Structure and Mechanism of Activation of TBK1

All present enzymatic activity of Crystal Structure and Mechanism of Activation of TBK1:
2.7.11.1;

The structure of Crystal Structure and Mechanism of Activation of TBK1, PDB code: 4iwp was solved by D.Panne, A.Larabi, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	48.51 / 3.06
Space group	P 32 2 1
Cell size a, b, c (Å), α, β, γ (°)	135.410, 135.410, 86.360, 90.00, 90.00, 120.00
R / Rfree (%)	28 / 33.5

The binding sites of Iodine atom in the Crystal Structure and Mechanism of Activation of TBK1 (pdb code 4iwp). This binding sites where shown within 5.0 Angstroms radius around Iodine atom.
In total only one binding site of Iodine was determined in the Crystal Structure and Mechanism of Activation of TBK1, PDB code: 4iwp:

Iodine binding site 1 out of 1 in the Crystal Structure and Mechanism of Activation of TBK1


Mono view


Stereo pair view

A full contact list of Iodine with other atoms in the I binding site number 1 of Crystal Structure and Mechanism of Activation of TBK1 within 5.0Å range: probe atom residue distance (Å) B Occ A:I701 b:94.3 occ:1.00 I01 A:BX7701 0.0 94.3 1.0 C28 A:BX7701 2.1 68.0 1.0 C30 A:BX7701 2.8 63.3 1.0 C26 A:BX7701 2.8 67.7 1.0 N07 A:BX7701 3.0 66.0 1.0 OG1 A:THR156 3.3 0.7 1.0 O04 A:BX7701 3.7 93.8 1.0 CG A:MET86 3.8 77.5 1.0 CB A:MET86 3.8 94.5 1.0 N11 A:BX7701 4.0 61.8 1.0 CB A:THR156 4.1 94.2 1.0 CE A:MET86 4.1 0.5 1.0 CB A:ALA36 4.2 86.5 1.0 N10 A:BX7701 4.2 54.4 1.0 CG1 A:VAL68 4.4 97.0 1.0 CG2 A:THR156 4.5 85.3 1.0 CG2 A:VAL23 4.5 76.9 1.0 CG1 A:VAL23 4.5 95.0 1.0 C21 A:BX7701 4.5 77.0 1.0 C29 A:BX7701 4.6 92.5 1.0 C27 A:BX7701 4.7 67.4 1.0 SD A:MET86 4.8 96.9 1.0 C23 A:BX7701 4.9 93.4 1.0 O A:GLU87 5.0 75.7 1.0

A.Larabi, J.M.Devos, S.L.Ng, M.H.Nanao, A.Round, T.Maniatis, D.Panne. Crystal Structure and Mechanism of Activation of Tank-Binding Kinase 1. Cell Rep V. 3 734 2013.
ISSN: ESSN 2211-1247
PubMed: 23453971
DOI: 10.1016/J.CELREP.2013.01.034