Chlorine in PDB 4lo6: HA70-ALPHA2,6-Sialc

The structure of HA70-ALPHA2,6-Sialc, PDB code: 4lo6 was solved by K.Lee, S.Gu, L.Jin, T.T.Le, L.W.Cheng, J.Strotmeier, A.M.Kruel, G.Yao, K.Perry, A.Rummel, R.Jin, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	44.84 / 2.30
Space group	I 41 3 2
Cell size a, b, c (Å), α, β, γ (°)	261.480, 261.480, 261.480, 90.00, 90.00, 90.00
R / Rfree (%)	18.6 / 20.9

The binding sites of Chlorine atom in the HA70-ALPHA2,6-Sialc (pdb code 4lo6). 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 HA70-ALPHA2,6-Sialc, PDB code: 4lo6:

Chlorine binding site 1 out of 1 in the HA70-ALPHA2,6-Sialc


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of HA70-ALPHA2,6-Sialc within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl703 b:38.3 occ:1.00 N B:TYR561 3.1 39.1 1.0 N B:ARG619 3.1 36.7 1.0 O B:HOH839 3.2 30.7 1.0 N B:ASN562 3.3 38.3 1.0 N B:SER560 3.4 40.4 1.0 CA B:ILE618 3.7 32.3 1.0 CB B:THR559 3.7 42.0 1.0 CA B:TYR561 3.9 37.2 1.0 C B:ILE618 3.9 35.7 1.0 O B:ARG619 3.9 39.7 1.0 CG1 B:ILE618 4.0 36.0 1.0 C B:SER560 4.0 38.9 1.0 CA B:SER560 4.0 46.8 1.0 C B:TYR561 4.1 44.2 1.0 CB B:ASN562 4.1 41.1 1.0 CA B:ARG619 4.1 32.1 1.0 O B:ASN617 4.1 35.9 1.0 CB B:TYR561 4.2 33.7 1.0 CA B:ASN562 4.2 40.5 1.0 CB B:SER560 4.2 39.4 1.0 CB B:ARG619 4.3 34.4 1.0 C B:THR559 4.3 44.2 1.0 CG2 B:THR559 4.3 37.4 1.0 CG B:ASN562 4.3 42.3 1.0 CA B:THR559 4.4 36.8 1.0 C B:ARG619 4.4 38.6 1.0 CB B:ILE618 4.4 37.3 1.0 ND2 B:ASN562 4.5 43.2 1.0 O B:ASN562 4.5 45.2 1.0 OG1 B:THR559 4.6 42.2 1.0 CG B:ARG619 4.7 42.8 1.0 CD1 B:TYR561 4.7 40.3 1.0 N B:ILE618 4.8 32.1 1.0 C B:ASN617 4.8 44.0 1.0 CG B:TYR561 4.9 38.9 1.0 C B:ASN562 4.9 47.2 1.0 OD1 B:ASN562 4.9 46.7 1.0 OG B:SER560 5.0 42.0 1.0

K.Lee, S.Gu, L.Jin, T.T.Le, L.W.Cheng, J.Strotmeier, A.M.Kruel, G.Yao, K.Perry, A.Rummel, R.Jin. Structure of A Bimodular Botulinum Neurotoxin Complex Provides Insights Into Its Oral Toxicity. Plos Pathog. V. 9 03690 2013.
ISSN: ISSN 1553-7366
PubMed: 24130488
DOI: 10.1371/JOURNAL.PPAT.1003690