Chlorine in PDB 6u0b: Neutron Crystal Structure of WTT4LD

All present enzymatic activity of Neutron Crystal Structure of WTT4LD:
3.2.1.17;

The structure of Neutron Crystal Structure of WTT4LD, PDB code: 6u0b was solved by M.J.Cuneo, D.A.Myles, L.Li, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	N/A / 1.95
Space group	P 32 2 1
Cell size a, b, c (Å), α, β, γ (°)	60.870, 60.870, 97.000, 90.00, 90.00, 120.00
R / Rfree (%)	21.9 / 25.1

The binding sites of Chlorine atom in the Neutron Crystal Structure of WTT4LD (pdb code 6u0b). 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 Neutron Crystal Structure of WTT4LD, PDB code: 6u0b:

Chlorine binding site 1 out of 1 in the Neutron Crystal Structure of WTT4LD


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of Neutron Crystal Structure of WTT4LD within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl201 b:28.4 occ:0.96 H A:ARG145 2.3 19.6 0.0 D A:ARG145 2.3 19.6 1.0 D1 A:HOH331 2.5 39.9 1.0 D A:ASN144 2.6 17.2 1.0 H A:ASN144 2.6 17.2 0.0 DB2 A:ASN144 2.7 22.4 1.0 DB A:THR142 2.9 21.8 1.0 D2 A:HOH331 2.9 39.9 1.0 O A:HOH331 3.0 33.3 1.0 DA A:THR142 3.1 19.2 1.0 DB2 A:ARG145 3.2 21.9 1.0 N A:ARG145 3.3 16.3 1.0 N A:ASN144 3.3 14.3 1.0 C A:THR142 3.5 21.9 1.0 DD2 A:PRO143 3.5 23.9 1.0 CA A:THR142 3.6 16.0 1.0 CB A:ASN144 3.6 18.7 1.0 CB A:THR142 3.7 18.1 1.0 N A:PRO143 3.7 20.7 1.0 O A:THR142 3.8 17.2 1.0 CA A:ASN144 3.8 20.1 1.0 DG22 A:THR142 3.8 26.6 1.0 CB A:ARG145 4.0 18.3 1.0 DB3 A:ARG145 4.0 21.9 1.0 C A:ASN144 4.0 21.6 1.0 CD A:PRO143 4.2 19.9 1.0 CA A:ARG145 4.3 16.3 1.0 C A:PRO143 4.3 18.5 1.0 HD22 A:ASN144 4.3 37.0 0.3 DD21 A:ASN144 4.3 37.0 1.0 DB3 A:ASN144 4.3 22.4 1.0 CG2 A:THR142 4.3 22.2 1.0 H A:ALA146 4.5 22.2 0.0 D A:ALA146 4.5 22.2 1.0 CG A:ASN144 4.6 32.4 1.0 CA A:PRO143 4.6 18.5 1.0 DG2 A:PRO143 4.7 22.2 1.0 ND2 A:ASN144 4.8 30.8 1.0 HH12 A:ARG148 4.9 24.5 0.1 DH12 A:ARG148 4.9 24.5 0.9 OG1 A:THR142 4.9 19.6 1.0 DG1 A:THR142 4.9 23.5 1.0 DA A:ASN144 4.9 24.1 1.0 DA A:ARG145 4.9 19.5 1.0 HG1 A:THR142 4.9 23.5 0.0 DG21 A:THR142 5.0 26.6 1.0 N A:THR142 5.0 17.1 1.0 DD3 A:PRO143 5.0 23.9 1.0 CG A:PRO143 5.0 18.5 1.0

L.Li, D.A.Myles, M.J.Cuneo. Solvent Entry Into Cavities of T4 Lysozyme. To Be Published.