Chlorine in PDB 6u0c: Neutron Crystal Structure of WTT4LE

All present enzymatic activity of Neutron Crystal Structure of WTT4LE:
3.2.1.17;

The structure of Neutron Crystal Structure of WTT4LE, PDB code: 6u0c 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 / 2.00
Space group	P 32 2 1
Cell size a, b, c (Å), α, β, γ (°)	60.870, 60.870, 96.870, 90.00, 90.00, 120.00
R / Rfree (%)	21.8 / 25

The binding sites of Chlorine atom in the Neutron Crystal Structure of WTT4LE (pdb code 6u0c). 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 WTT4LE, PDB code: 6u0c:

Chlorine binding site 1 out of 1 in the Neutron Crystal Structure of WTT4LE


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 WTT4LE within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl201 b:31.5 occ:0.89 D A:ARG145 2.3 22.7 0.9 H A:ARG145 2.3 22.7 0.1 H A:ASN144 2.5 21.7 0.2 D A:ASN144 2.5 21.7 0.8 DB2 A:ASN144 2.7 30.6 1.0 O A:HOH351 2.9 40.5 1.0 DB A:THR142 3.0 26.5 1.0 DA A:THR142 3.0 24.5 1.0 D1 A:HOH351 3.1 48.6 1.0 N A:ASN144 3.2 18.1 1.0 N A:ARG145 3.3 18.9 1.0 C A:THR142 3.4 24.3 1.0 DD2 A:PRO143 3.5 23.9 1.0 CA A:THR142 3.5 20.4 1.0 DB2 A:ARG145 3.6 26.5 1.0 CB A:ASN144 3.6 25.5 1.0 D2 A:HOH351 3.7 48.6 1.0 CB A:THR142 3.7 22.1 1.0 N A:PRO143 3.7 28.2 1.0 DB3 A:ARG145 3.8 26.5 1.0 O A:THR142 3.8 21.3 1.0 CA A:ASN144 3.8 25.0 1.0 DG21 A:THR142 3.9 27.7 1.0 DD22 A:ASN144 4.0 43.0 0.6 HD22 A:ASN144 4.0 43.0 0.4 C A:ASN144 4.0 28.6 1.0 CB A:ARG145 4.1 22.1 1.0 CD A:PRO143 4.1 19.9 1.0 C A:PRO143 4.2 24.8 1.0 CA A:ARG145 4.3 17.5 1.0 DB3 A:ASN144 4.3 30.6 1.0 CG2 A:THR142 4.4 23.1 1.0 DG2 A:PRO143 4.5 29.7 1.0 CG A:ASN144 4.5 30.9 1.0 ND2 A:ASN144 4.6 35.8 1.0 H A:ALA146 4.6 32.2 1.0 D A:ALA146 4.6 32.2 0.0 CA A:PRO143 4.6 20.9 1.0 DA A:ASN144 4.8 30.0 1.0 DG1 A:THR142 4.9 27.7 0.7 HG1 A:THR142 4.9 27.7 0.3 DA A:ARG145 4.9 21.0 1.0 CG A:PRO143 4.9 24.8 1.0 OG1 A:THR142 4.9 23.1 1.0 DD3 A:PRO143 4.9 23.9 1.0 N A:THR142 4.9 20.4 1.0 DH11 A:ARG148 5.0 24.5 0.9 HH12 A:ARG148 5.0 24.5 0.5

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