Chlorine in PDB 2l8m: Reduced and Co-Bound Cytochrome P450CAM (CYP101A1)

All present enzymatic activity of Reduced and Co-Bound Cytochrome P450CAM (CYP101A1):
1.14.15.1;

The structure of Reduced and Co-Bound Cytochrome P450CAM (CYP101A1) also contains other interesting chemical elements:

Potassium	(K)	4 atoms
Iron	(Fe)	1 atom

The binding sites of Chlorine atom in the Reduced and Co-Bound Cytochrome P450CAM (CYP101A1) (pdb code 2l8m). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Reduced and Co-Bound Cytochrome P450CAM (CYP101A1), PDB code: 2l8m:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the Reduced and Co-Bound Cytochrome P450CAM (CYP101A1)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Reduced and Co-Bound Cytochrome P450CAM (CYP101A1) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl422 b:0.0 occ:1.00 H2 A:HOH519 2.2 0.0 1.0 H2 A:HOH1602 2.4 0.0 1.0 H2 A:HOH1369 2.6 0.0 1.0 O A:HOH519 3.1 0.0 1.0 H1 A:HOH1602 3.2 0.0 1.0 O A:HOH1602 3.2 0.0 1.0 H1 A:HOH519 3.3 0.0 1.0 O A:HOH1369 3.5 0.0 1.0 H2 A:HOH1620 3.5 0.0 1.0 H2 A:HOH1858 3.9 0.0 1.0 H1 A:HOH1369 4.0 0.0 1.0 O A:HOH1620 4.0 0.0 1.0 H1 A:HOH885 4.2 0.0 1.0 H2 A:HOH885 4.3 0.0 1.0 O A:HOH1858 4.3 0.0 1.0 O A:HOH885 4.7 0.0 1.0 H1 A:HOH1620 4.8 0.0 1.0 H2 A:HOH964 5.0 0.0 1.0

Chlorine binding site 2 out of 3 in the Reduced and Co-Bound Cytochrome P450CAM (CYP101A1)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Reduced and Co-Bound Cytochrome P450CAM (CYP101A1) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl423 b:0.0 occ:1.00 H2 A:HOH542 2.0 0.0 1.0 H2 A:HOH1877 2.2 0.0 1.0 H1 A:HOH514 2.3 0.0 1.0 H1 A:HOH470 2.3 0.0 1.0 O A:HOH542 2.9 0.0 1.0 O A:HOH1877 3.1 0.0 1.0 O A:HOH514 3.2 0.0 1.0 O A:HOH470 3.3 0.0 1.0 H1 A:HOH542 3.4 0.0 1.0 H1 A:HOH1877 3.4 0.0 1.0 H2 A:HOH1022 3.6 0.0 1.0 H2 A:HOH470 3.6 0.0 1.0 H2 A:HOH514 3.7 0.0 1.0 O A:HOH1022 4.1 0.0 1.0 H2 A:HOH1961 4.7 0.0 1.0 H1 A:HOH1022 4.9 0.0 1.0 O A:HOH742 5.0 0.0 1.0

Chlorine binding site 3 out of 3 in the Reduced and Co-Bound Cytochrome P450CAM (CYP101A1)


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Reduced and Co-Bound Cytochrome P450CAM (CYP101A1) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl424 b:0.0 occ:1.00 H2 A:HOH3585 2.3 0.0 1.0 O A:HOH3585 3.1 0.0 1.0 H1 A:HOH3585 3.4 0.0 1.0 H2 A:HOH3556 4.6 0.0 1.0 H2 A:HOH3134 4.7 0.0 1.0 H1 A:HOH2800 4.7 0.0 1.0 H1 A:HOH1895 5.0 0.0 1.0

E.K.Asciutto, M.Dang, S.S.Pochapsky, J.D.Madura, T.C.Pochapsky. Experimentally Restrained Molecular Dynamics Simulations For Characterizing the Open States of Cytochrome P450(Cam). Biochemistry V. 50 1664 2011.
ISSN: ISSN 0006-2960
PubMed: 21265500
DOI: 10.1021/BI101820D