Chlorine in PDB 3k6m: Dynamic Domains of Succinyl-Coa:3-Ketoacid-Coenzyme A Transferase From Pig Heart.

All present enzymatic activity of Dynamic Domains of Succinyl-Coa:3-Ketoacid-Coenzyme A Transferase From Pig Heart.:
2.8.3.5;

The structure of Dynamic Domains of Succinyl-Coa:3-Ketoacid-Coenzyme A Transferase From Pig Heart., PDB code: 3k6m was solved by S.Coker, A.Lloyd, E.Mitchell, G.R.Lewis, P.Shoolingin-Jordan, A.R.Coker, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	20.00 / 1.50
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	73.715, 133.566, 102.230, 90.00, 104.98, 90.00
R / Rfree (%)	16.5 / 18.5

The binding sites of Chlorine atom in the Dynamic Domains of Succinyl-Coa:3-Ketoacid-Coenzyme A Transferase From Pig Heart. (pdb code 3k6m). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the Dynamic Domains of Succinyl-Coa:3-Ketoacid-Coenzyme A Transferase From Pig Heart., PDB code: 3k6m:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the Dynamic Domains of Succinyl-Coa:3-Ketoacid-Coenzyme A Transferase From Pig Heart.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Dynamic Domains of Succinyl-Coa:3-Ketoacid-Coenzyme A Transferase From Pig Heart. within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl6000 b:19.5 occ:0.80 NZ A:LYS329 3.2 29.1 1.0 O A:HOH7211 3.3 39.0 1.0 ND2 A:ASN52 3.3 25.1 1.0 NE2 A:GLN99 3.4 26.1 1.0 ND2 A:ASN51 3.4 26.4 1.0 CB A:TYR76 3.7 25.1 1.0 CE1 A:PHE25 3.8 24.6 1.0 CZ A:PHE25 3.9 23.1 1.0 CE A:LYS329 4.0 28.0 1.0 CD2 A:TYR76 4.2 27.9 1.0 CG A:ASN52 4.2 24.2 1.0 CG A:TYR76 4.3 25.6 1.0 OG A:SER75 4.3 24.6 1.0 OD1 A:ASN52 4.3 24.3 1.0 CD A:GLN99 4.5 24.8 1.0 CG A:ASN51 4.5 23.9 1.0 CD1 A:PHE25 4.6 23.6 1.0 O A:HOH7170 4.7 31.4 1.0 O A:ALA327 4.7 26.6 1.0 OD1 A:ASN51 4.8 24.7 1.0 CA A:GLY385 4.8 23.8 1.0 OE1 A:GLN99 4.9 26.1 1.0 CE2 A:PHE25 4.9 23.5 1.0 CA A:TYR76 4.9 24.5 1.0

Chlorine binding site 2 out of 2 in the Dynamic Domains of Succinyl-Coa:3-Ketoacid-Coenzyme A Transferase From Pig Heart.


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Dynamic Domains of Succinyl-Coa:3-Ketoacid-Coenzyme A Transferase From Pig Heart. within 5.0Å range: probe atom residue distance (Å) B Occ D:Cl6001 b:15.7 occ:0.80 NZ D:LYS329 3.1 31.2 1.0 ND2 D:ASN52 3.3 23.9 1.0 NE2 D:GLN99 3.5 28.9 1.0 ND2 D:ASN51 3.5 24.8 1.0 CE1 D:PHE25 3.7 24.9 1.0 CB D:TYR76 3.7 24.5 0.5 CB D:TYR76 3.7 22.8 0.5 CZ D:PHE25 3.9 23.8 1.0 CD2 D:TYR76 4.0 28.3 0.5 CE D:LYS329 4.1 30.1 1.0 CG D:ASN52 4.2 24.4 1.0 CG D:TYR76 4.2 24.9 0.5 OD1 D:ASN52 4.2 24.9 1.0 CD2 D:TYR76 4.2 25.3 0.5 OG D:SER75 4.3 23.4 1.0 CG D:TYR76 4.3 23.0 0.5 CD1 D:PHE25 4.5 22.8 1.0 CD D:GLN99 4.5 25.4 1.0 CG D:ASN51 4.6 24.5 1.0 O D:HOH767 4.7 27.7 1.0 O D:ALA327 4.7 27.8 1.0 CA D:GLY385 4.8 21.8 1.0 OE1 D:GLN99 4.8 28.2 1.0 OD1 D:ASN51 4.9 26.2 1.0 CE2 D:PHE25 4.9 23.7 1.0 CA D:TYR76 5.0 23.7 0.5 CA D:TYR76 5.0 23.2 0.5

S.F.Coker, A.J.Lloyd, E.Mitchell, G.R.Lewis, A.R.Coker, P.M.Shoolingin-Jordan. The High-Resolution Structure of Pig Heart Succinyl-Coa:3-Oxoacid Coenzyme A Transferase. Acta Crystallogr.,Sect.D V. 66 797 2010.
ISSN: ISSN 0907-4449
PubMed: 20606260
DOI: 10.1107/S0907444910018366