Chlorine in PDB 6phi: Crystal Structure of Native Glucagon in Space Group I41 at 1.1 A Resolution

The structure of Crystal Structure of Native Glucagon in Space Group I41 at 1.1 A Resolution, PDB code: 6phi was solved by P.A.Mroz, G.Gonzalez-Gutierrez, R.D.Dimarchi, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	23.61 / 1.10
Space group	I 41
Cell size a, b, c (Å), α, β, γ (°)	42.555, 42.555, 28.376, 90.00, 90.00, 90.00
R / Rfree (%)	13.6 / 13.9

The binding sites of Chlorine atom in the Crystal Structure of Native Glucagon in Space Group I41 at 1.1 A Resolution (pdb code 6phi). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Crystal Structure of Native Glucagon in Space Group I41 at 1.1 A Resolution, PDB code: 6phi:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Native Glucagon in Space Group I41 at 1.1 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Crystal Structure of Native Glucagon in Space Group I41 at 1.1 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl101 b:61.7 occ:1.00 HE A:ARG18 2.1 17.8 1.0 NE A:ARG18 3.0 14.8 1.0 HH21 A:ARG18 3.1 23.0 1.0 HA A:ARG18 3.2 8.8 1.0 O A:HOH221 3.5 33.4 1.0 O A:HOH213 3.5 18.3 1.0 HD3 A:ARG18 3.6 14.6 1.0 HB2 A:ARG18 3.6 9.7 1.0 O A:HOH201 3.7 36.5 1.0 NH2 A:ARG18 3.7 19.1 1.0 CZ A:ARG18 3.8 17.7 1.0 CD A:ARG18 3.8 12.1 1.0 CA A:ARG18 4.0 7.3 1.0 CB A:ARG18 4.2 8.1 1.0 N A:ARG18 4.4 7.2 1.0 HB3 A:ASP21 4.5 12.3 1.0 HB3 A:ARG17 4.5 13.9 1.0 HB2 A:ASP21 4.5 12.3 1.0 HH22 A:ARG18 4.5 23.0 1.0 O A:HOH229 4.6 43.0 1.0 HD2 A:ARG18 4.6 14.6 1.0 CG A:ARG18 4.6 10.3 1.0 O A:ARG17 4.7 8.1 1.0 HE A:ARG17 4.7 24.5 1.0 C A:ARG17 4.7 7.7 1.0 H A:ARG18 4.7 8.7 1.0 HB2 A:ARG17 4.9 13.9 1.0 CB A:ASP21 4.9 10.2 1.0 HH21 A:ARG17 4.9 28.0 1.0 OD2 A:ASP21 5.0 13.4 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Native Glucagon in Space Group I41 at 1.1 A Resolution


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of Native Glucagon in Space Group I41 at 1.1 A Resolution within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl102 b:35.3 occ:1.00 HG1 A:THR7 2.3 17.0 1.0 H A:THR7 2.6 11.2 1.0 O A:HOH224 2.7 48.4 1.0 HA3 A:GLY4 2.8 16.5 1.0 H A:GLY4 2.8 16.9 1.0 HB3 A:PHE6 3.0 11.8 1.0 OG1 A:THR7 3.1 14.1 1.0 O A:HOH218 3.3 26.2 1.0 CA A:GLY4 3.3 13.7 1.0 N A:GLY4 3.4 14.0 1.0 HB A:THR7 3.4 14.8 1.0 N A:THR7 3.4 9.3 1.0 H A:PHE6 3.5 12.7 1.0 C A:GLY4 3.7 12.8 1.0 CB A:THR7 3.7 12.3 1.0 CB A:PHE6 3.9 9.8 1.0 O A:GLY4 3.9 12.2 1.0 N A:PHE6 4.0 10.6 1.0 HD1 A:PHE6 4.2 12.9 1.0 CA A:THR7 4.2 9.7 1.0 HA2 A:GLY4 4.2 16.5 1.0 HB2 A:PHE6 4.2 11.8 1.0 CA A:PHE6 4.3 9.7 1.0 N A:THR5 4.3 13.3 1.0 C A:PHE6 4.3 9.1 1.0 H A:THR5 4.5 16.0 1.0 C A:GLN3 4.6 14.7 1.0 HA A:GLN3 4.6 19.2 1.0 HA A:THR7 4.7 11.7 1.0 CD1 A:PHE6 4.9 10.7 1.0 C A:THR5 4.9 11.6 1.0 CG A:PHE6 4.9 9.4 1.0 H A:SER8 4.9 10.0 1.0 H A:SER8 4.9 10.2 0.0

P.A.Mroz, G.Gonzalez-Gutierrez, R.D.Dimarchi. High Resolution X-Ray Structure of Glucagon and Selected Stereo-Inversed Analogs in Novel Crystallographic Packing Arrangement. To Be Published.