Chlorine in PDB 1xwa: Drospohila Thioredoxin, Oxidized, P41212

The structure of Drospohila Thioredoxin, Oxidized, P41212, PDB code: 1xwa was solved by M.C.Wahl, A.Irmler, B.Hecker, R.H.Schirmer, K.Becker, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	20.00 / 2.20
Space group	P 41 21 2
Cell size a, b, c (Å), α, β, γ (°)	92.544, 92.544, 97.624, 90.00, 90.00, 90.00
R / Rfree (%)	22.6 / 28.8

The structure of Drospohila Thioredoxin, Oxidized, P41212 also contains other interesting chemical elements:

Cadmium

(Cd)

3 atoms

The binding sites of Chlorine atom in the Drospohila Thioredoxin, Oxidized, P41212 (pdb code 1xwa). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Drospohila Thioredoxin, Oxidized, P41212, PDB code: 1xwa:

Chlorine binding site 1 out of 1 in the Drospohila Thioredoxin, Oxidized, P41212


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Drospohila Thioredoxin, Oxidized, P41212 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl901 b:26.5 occ:1.00 CD A:CD802 2.6 26.6 1.0 CD A:CD801 2.7 27.5 1.0 NZ A:LYS41 3.3 27.1 1.0 O A:HOH903 3.4 25.1 1.0 OE2 A:GLU44 3.4 27.2 1.0 O A:HOH905 3.4 20.3 1.0 O A:HOH902 3.6 17.8 1.0 OE2 A:GLU99 3.6 29.2 1.0 O A:HOH904 3.7 14.9 1.0 O A:HOH968 3.8 45.2 1.0 CD A:GLU44 4.4 29.5 1.0 CD A:GLU99 4.5 29.9 1.0 OE1 A:GLU44 4.6 26.3 1.0 OE1 A:GLU99 4.7 32.7 1.0 CE A:LYS41 4.7 28.7 1.0

M.C.Wahl, A.Irmler, B.Hecker, R.H.Schirmer, K.Becker. Comparative Structural Analysis of Oxidized and Reduced Thioredoxin From Drosophila Melanogaster J.Mol.Biol. V. 345 1119 2005.
ISSN: ISSN 0022-2836
PubMed: 15644209
DOI: 10.1016/J.JMB.2004.11.004