Chlorine in PDB 4wbh: Structure of the Wnt Deacylase Notum - Crystal Form I Apo - 2.2A

The structure of Structure of the Wnt Deacylase Notum - Crystal Form I Apo - 2.2A, PDB code: 4wbh was solved by M.Zebisch, E.Y.Jones, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	87.72 / 2.20
Space group	P 21 21 2
Cell size a, b, c (Å), α, β, γ (°)	72.702, 175.433, 60.764, 90.00, 90.00, 90.00
R / Rfree (%)	21.5 / 26.2

The binding sites of Chlorine atom in the Structure of the Wnt Deacylase Notum - Crystal Form I Apo - 2.2A (pdb code 4wbh). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 4 binding sites of Chlorine where determined in the Structure of the Wnt Deacylase Notum - Crystal Form I Apo - 2.2A, PDB code: 4wbh:
Jump to Chlorine binding site number: 1; 2; 3; 4;

Chlorine binding site 1 out of 4 in the Structure of the Wnt Deacylase Notum - Crystal Form I Apo - 2.2A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Structure of the Wnt Deacylase Notum - Crystal Form I Apo - 2.2A within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl601 b:70.9 occ:1.00 NH1 A:ARG409 3.2 62.2 1.0 NH2 A:ARG409 3.2 58.5 1.0 CZ A:ARG409 3.6 60.3 1.0 NE2 A:HIS412 3.8 50.6 1.0 CD2 A:HIS412 4.4 49.6 1.0 SG A:CYS432 4.5 64.7 1.0 CE1 A:HIS412 4.9 48.9 1.0 NE A:ARG409 5.0 58.7 1.0

Chlorine binding site 2 out of 4 in the Structure of the Wnt Deacylase Notum - Crystal Form I Apo - 2.2A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Structure of the Wnt Deacylase Notum - Crystal Form I Apo - 2.2A within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl602 b:73.9 occ:1.00 O A:HOH722 2.9 51.1 1.0 N A:SER395 3.8 43.4 1.0 CA A:ARG394 4.2 41.8 1.0 NH1 A:ARG394 4.3 61.6 1.0 CB A:SER395 4.4 46.5 1.0 CB A:ARG394 4.4 44.6 1.0 OG A:SER395 4.4 46.2 1.0 C A:ARG394 4.5 43.0 1.0 CA A:SER395 4.7 47.1 1.0

Chlorine binding site 3 out of 4 in the Structure of the Wnt Deacylase Notum - Crystal Form I Apo - 2.2A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Structure of the Wnt Deacylase Notum - Crystal Form I Apo - 2.2A within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl603 b:68.2 occ:1.00 NH1 A:ARG218 3.4 43.1 1.0 NH2 A:ARG90 3.6 51.6 1.0 NE2 A:HIS92 3.7 32.1 1.0 NH1 A:ARG90 3.8 56.9 1.0 NH2 A:ARG218 4.0 44.9 1.0 CZ A:ARG218 4.1 43.8 1.0 CZ A:ARG90 4.2 54.3 1.0 CD2 A:HIS92 4.3 31.6 1.0 CE1 A:HIS92 4.8 30.3 1.0

Chlorine binding site 4 out of 4 in the Structure of the Wnt Deacylase Notum - Crystal Form I Apo - 2.2A


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of Structure of the Wnt Deacylase Notum - Crystal Form I Apo - 2.2A within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl602 b:67.3 occ:1.00 NH1 B:ARG218 3.6 48.0 1.0 NH2 B:ARG218 3.9 47.7 1.0 NE2 B:HIS92 4.1 38.5 1.0 CZ B:ARG218 4.2 47.4 1.0 CD2 B:HIS92 4.5 37.5 1.0 NH1 B:ARG90 4.6 55.0 1.0 NH2 B:ARG90 4.6 56.8 1.0

S.Kakugawa, P.F.Langton, M.Zebisch, S.A.Howell, T.-H.Chang, Y.Liu, T.Feizi, G.Bineva, N.O'reilly, A.P.Snijders, E.Y.Jones, J.-P.Vincent. Notum Deacylates Wnt Proteins to Suppress Signalling Activity Nature 2015.
ISSN: ESSN 1476-4687
DOI: 10.1038/NATURE14259