Chlorine in PDB 5par: Crystal Structure of Factor Viia in Complex with 1H-Benzimidazol-2- Amine

All present enzymatic activity of Crystal Structure of Factor Viia in Complex with 1H-Benzimidazol-2- Amine:
3.4.21.21;

The structure of Crystal Structure of Factor Viia in Complex with 1H-Benzimidazol-2- Amine, PDB code: 5par was solved by M.Stihle, A.Mayweg, S.Roever, M.G.Rudolph, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	42.72 / 2.10
Space group	P 41 21 2
Cell size a, b, c (Å), α, β, γ (°)	95.479, 95.479, 116.331, 90.00, 90.00, 90.00
R / Rfree (%)	18.2 / 22

The structure of Crystal Structure of Factor Viia in Complex with 1H-Benzimidazol-2- Amine also contains other interesting chemical elements:

Calcium

(Ca)

1 atom

The binding sites of Chlorine atom in the Crystal Structure of Factor Viia in Complex with 1H-Benzimidazol-2- Amine (pdb code 5par). 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 Factor Viia in Complex with 1H-Benzimidazol-2- Amine, PDB code: 5par:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Factor Viia in Complex with 1H-Benzimidazol-2- Amine


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 Factor Viia in Complex with 1H-Benzimidazol-2- Amine within 5.0Å range: probe atom residue distance (Å) B Occ C:Cl502 b:80.0 occ:1.00 N C:GLU454 3.6 44.5 1.0 O C:HOH712 3.6 58.4 1.0 CA C:SER453 3.8 45.3 1.0 CB C:SER453 3.9 44.9 1.0 C C:SER453 4.2 44.7 1.0 CB C:GLU454 4.4 44.0 1.0 CA C:GLU454 4.6 44.4 1.0 CG C:GLU454 4.6 42.9 1.0 O C:GLU454 4.9 46.2 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Factor Viia in Complex with 1H-Benzimidazol-2- Amine


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 Factor Viia in Complex with 1H-Benzimidazol-2- Amine within 5.0Å range: probe atom residue distance (Å) B Occ C:Cl503 b:80.0 occ:1.00 NE C:ARG262 3.3 61.9 0.5 NH1 C:ARG262 3.4 61.4 0.5 O C:HOH723 3.4 60.7 1.0 N C:VAL459 3.7 48.1 1.0 CZ C:ARG262 3.7 62.0 0.5 CA C:GLY458 3.9 48.6 0.5 CA C:GLY458 4.0 48.8 0.5 CG2 C:VAL459 4.3 47.1 1.0 CD C:ARG262 4.3 61.2 0.5 NE C:ARG262 4.4 63.3 0.5 C C:GLY458 4.4 48.5 0.5 C C:GLY458 4.4 48.3 0.5 NH2 C:ARG262 4.6 64.0 0.5 CB C:VAL459 4.6 47.4 1.0 CA C:VAL459 4.7 47.6 1.0 CZ C:ARG262 4.9 64.3 0.5 CB C:TRP261 4.9 60.2 1.0 NH2 C:ARG262 4.9 62.6 0.5 N C:GLY458 5.0 48.8 0.5 N C:GLY458 5.0 48.7 0.5

A.Mayweg, S.Roever, M.G.Rudolph. Crystal Structure of A Factor Viia Complex To Be Published.