Chlorine in PDB 7ywj: Crystal Structure of An Engineered Tyca Variant, Tyca Ppla (L313P)

All present enzymatic activity of Crystal Structure of An Engineered Tyca Variant, Tyca Ppla (L313P):
5.1.1.11;

The structure of Crystal Structure of An Engineered Tyca Variant, Tyca Ppla (L313P), PDB code: 7ywj was solved by P.Mittl, A.Camus, G.Truong, G.Markert, D.Hilvert, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	48.86 / 1.75
Space group	P 21 21 21
Cell size a, b, c (Å), α, β, γ (°)	60.043, 60.419, 249.243, 90, 90, 90
R / Rfree (%)	17.5 / 20.9

The binding sites of Chlorine atom in the Crystal Structure of An Engineered Tyca Variant, Tyca Ppla (L313P) (pdb code 7ywj). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total only one binding site of Chlorine was determined in the Crystal Structure of An Engineered Tyca Variant, Tyca Ppla (L313P), PDB code: 7ywj:

Chlorine binding site 1 out of 1 in the Crystal Structure of An Engineered Tyca Variant, Tyca Ppla (L313P)


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 An Engineered Tyca Variant, Tyca Ppla (L313P) within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl503 b:75.6 occ:1.00 O A:HOH1058 2.9 63.6 1.0 NE2 A:GLN41 3.2 38.7 1.0 ND1 A:HIS174 3.3 47.2 1.0 O A:HOH652 3.4 41.2 1.0 O A:HOH736 3.6 32.4 1.0 CE1 A:HIS174 4.0 47.7 1.0 CG A:GLN41 4.1 29.4 1.0 CD A:GLN41 4.1 35.6 1.0 CG A:HIS174 4.5 44.7 1.0 CB A:HIS174 4.8 40.8 1.0 O A:HOH968 4.8 54.2 1.0 CA A:HIS174 4.9 39.0 1.0 OE1 A:GLU44 4.9 30.0 1.0

A.Camus, G.Truong, P.R.E.Mittl, G.Markert, D.Hilvert. Reprogramming Nonribosomal Peptide Synthetases For Site-Specific Insertion of Alpha-Hydroxy Acids. J.Am.Chem.Soc. V. 144 17567 2022.
ISSN: ESSN 1520-5126
PubMed: 36070491
DOI: 10.1021/JACS.2C07013