Chlorine in PDB 1o86: Crystal Structure of Human Angiotensin Converting Enzyme in Complex with Lisinopril.

All present enzymatic activity of Crystal Structure of Human Angiotensin Converting Enzyme in Complex with Lisinopril.:
3.4.15.1;

The structure of Crystal Structure of Human Angiotensin Converting Enzyme in Complex with Lisinopril., PDB code: 1o86 was solved by R.Natesh, S.L.U.Schwager, E.D.Sturrock, K.R.Acharya, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	47.14 / 2.00
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	56.470, 84.900, 133.990, 90.00, 90.00, 90.00
R / Rfree (%)	18 / 22

The structure of Crystal Structure of Human Angiotensin Converting Enzyme in Complex with Lisinopril. also contains other interesting chemical elements:

Zinc

(Zn)

1 atom

The binding sites of Chlorine atom in the Crystal Structure of Human Angiotensin Converting Enzyme in Complex with Lisinopril. (pdb code 1o86). 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 Human Angiotensin Converting Enzyme in Complex with Lisinopril., PDB code: 1o86:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Crystal Structure of Human Angiotensin Converting Enzyme in Complex with Lisinopril.


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 Human Angiotensin Converting Enzyme in Complex with Lisinopril. within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl703 b:12.4 occ:1.00 NE A:ARG186 3.2 13.0 1.0 O A:HOH2472 3.2 11.9 1.0 NH1 A:ARG489 3.2 10.8 1.0 NE1 A:TRP485 3.3 12.5 1.0 NH1 A:ARG186 3.4 12.8 1.0 CZ2 A:TRP486 3.5 9.2 1.0 NE A:ARG489 3.7 11.4 1.0 CZ A:ARG186 3.7 11.1 1.0 CZ A:ARG489 3.7 12.1 1.0 CB A:ASP507 3.8 10.8 1.0 CH2 A:TRP486 4.1 8.8 1.0 CE2 A:TRP485 4.1 10.9 1.0 CZ2 A:TRP485 4.3 11.4 1.0 CD A:ARG186 4.3 12.8 1.0 CE2 A:TRP486 4.4 7.8 1.0 CD1 A:TRP485 4.4 11.2 1.0 CZ2 A:TRP182 4.5 12.2 1.0 CG A:ASP507 4.5 12.1 1.0 O A:ASP507 4.6 11.7 1.0 C A:ASP507 4.7 10.5 1.0 NE1 A:TRP486 4.7 8.2 1.0 O A:HOH2310 4.8 9.0 1.0 CA A:ASP507 4.8 10.4 1.0 NH2 A:ARG489 4.8 7.6 1.0 CD A:ARG489 4.8 10.0 1.0 OD2 A:ASP507 4.9 13.5 1.0

Chlorine binding site 2 out of 2 in the Crystal Structure of Human Angiotensin Converting Enzyme in Complex with Lisinopril.


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 Human Angiotensin Converting Enzyme in Complex with Lisinopril. within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl704 b:15.3 occ:1.00 OH A:TYR224 3.0 10.7 1.0 NE A:ARG522 3.1 9.5 1.0 O A:HOH2231 3.1 9.3 1.0 CB A:ARG522 3.4 10.4 1.0 NH2 A:ARG522 3.5 10.0 1.0 CB A:PRO407 3.6 12.1 1.0 CB A:PRO519 3.6 8.8 1.0 N A:ARG522 3.6 10.6 1.0 CG2 A:ILE521 3.6 9.7 1.0 CE1 A:TYR224 3.7 10.9 1.0 CZ A:ARG522 3.8 9.9 1.0 CZ A:TYR224 3.8 11.7 1.0 CG A:PRO407 3.9 11.6 1.0 CG A:ARG522 3.9 11.1 1.0 CA A:ARG522 3.9 9.7 1.0 CE A:MET223 4.0 17.5 1.0 CD A:ARG522 4.1 10.5 1.0 C A:ILE521 4.5 10.1 1.0 CG A:PRO519 4.6 8.4 1.0 C A:PRO519 4.6 8.6 1.0 N A:ILE521 4.6 8.8 1.0 CA A:PRO519 4.7 9.2 1.0 O A:PRO519 4.7 8.7 1.0 CD A:PRO407 4.8 10.5 1.0 CB A:ILE521 4.8 9.0 1.0 CA A:ILE521 4.9 9.2 1.0 O A:HOH2432 4.9 8.3 1.0 N A:TYR520 4.9 8.9 1.0 CD1 A:TYR224 4.9 10.5 1.0

R.Natesh, S.L.U.Schwager, E.D.Sturrock, K.R.Acharya. Crystal Structure of the Human Angiotensin-Converting Enzyme-Lisinopril Complex Nature V. 421 551 2003.
ISSN: ISSN 0028-0836
PubMed: 12540854
DOI: 10.1038/NATURE01370