Chlorine in PDB 9p8z: Crystal Structure of Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis

All present enzymatic activity of Crystal Structure of Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis:
3.5.4.16;

The structure of Crystal Structure of Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis, PDB code: 9p8z was solved by Seattle Structural Genomics Center For Infectious Disease, Seattlestructural Genomics Center For Infectious Disease (Ssgcid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	48.76 / 2.74
Space group	P 1
Cell size a, b, c (Å), α, β, γ (°)	87.547, 109.121, 122.548, 89.11, 88.12, 77.95
R / Rfree (%)	21 / 25.9

The structure of Crystal Structure of Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis also contains other interesting chemical elements:

Zinc

(Zn)

20 atoms

The binding sites of Chlorine atom in the Crystal Structure of Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis (pdb code 9p8z). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Crystal Structure of Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis, PDB code: 9p8z:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the Crystal Structure of Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis


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 Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis within 5.0Å range: probe atom residue distance (Å) B Occ F:Cl502 b:70.4 occ:1.00 O F:ILE199 3.5 76.1 1.0 O F:LEU200 3.5 104.5 1.0 OE2 F:GLU83 3.8 60.9 1.0 OE1 F:GLU158 4.0 55.4 1.0 O F:ARG201 4.0 79.3 1.0 C F:LEU200 4.1 98.8 1.0 OE2 F:GLU158 4.3 68.9 1.0 CA F:LEU200 4.4 97.1 1.0 NE2 F:HIS102 4.5 47.7 1.0 CE1 F:HIS102 4.5 44.1 1.0 CD F:GLU158 4.6 61.5 1.0 C F:ARG201 4.6 82.9 1.0 NZ F:LYS82 4.6 70.4 1.0 C F:ILE199 4.7 80.6 1.0 CE F:LYS82 4.8 62.4 1.0

Chlorine binding site 2 out of 3 in the Crystal Structure of Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis


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 Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis within 5.0Å range: probe atom residue distance (Å) B Occ G:Cl502 b:68.0 occ:1.00 CG G:ARG38 3.0 70.8 1.0 CD G:ARG38 3.3 64.7 1.0 N G:GLY40 3.5 71.1 1.0 NH1 G:ARG38 3.5 66.4 1.0 N G:ASP39 3.7 77.2 1.0 CB G:ASP39 3.9 79.1 1.0 CA G:ASP39 4.1 74.6 1.0 C G:ASP39 4.2 72.2 1.0 NE G:ARG38 4.3 58.3 1.0 CA G:GLY40 4.3 65.5 1.0 NH2 J:ARG135 4.3 54.5 1.0 CZ G:ARG38 4.3 62.7 1.0 CB G:ARG38 4.5 71.8 1.0 C G:ARG38 4.7 77.1 1.0

Chlorine binding site 3 out of 3 in the Crystal Structure of Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Crystal Structure of Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis within 5.0Å range: probe atom residue distance (Å) B Occ J:Cl502 b:79.7 occ:1.00 OE2 J:GLU83 3.7 59.9 1.0 OE1 J:GLU158 3.7 48.4 1.0 O J:LEU200 3.8 85.5 1.0 O J:ILE199 4.1 63.1 1.0 OE2 J:GLU158 4.5 59.2 1.0 CD J:GLU158 4.5 48.1 1.0 NE2 J:HIS102 4.6 41.9 1.0 C J:LEU200 4.6 81.5 1.0 O J:ARG201 4.6 83.5 1.0 CE1 J:HIS102 4.7 45.6 1.0 CA J:LEU200 4.9 77.5 1.0 CA J:LYS202 5.0 94.2 1.0 CD J:GLU83 5.0 59.7 1.0 C J:ARG201 5.0 88.5 1.0

S.Seibold, L.Liu, S.Lovell, K.P.Battaile. Crystal Structure of Gtp Cyclohydrolase 1 (Fole) From Mycobacterium Tuberculosis To Be Published.