Chlorine in PDB 7wan: Crystal Structure of Halotag Complexed with UL2

All present enzymatic activity of Crystal Structure of Halotag Complexed with UL2:
3.8.1.5;

The structure of Crystal Structure of Halotag Complexed with UL2, PDB code: 7wan was solved by M.Pratyush, M.Kang, H.Lee, C.Lee, H.Rhee, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	32.28 / 2.28
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	43.906, 72.764, 44.432, 90, 109.3, 90
R / Rfree (%)	17.8 / 22.8

The binding sites of Chlorine atom in the Crystal Structure of Halotag Complexed with UL2 (pdb code 7wan). 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 Halotag Complexed with UL2, PDB code: 7wan:

Chlorine binding site 1 out of 1 in the Crystal Structure of Halotag Complexed with UL2


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 Halotag Complexed with UL2 within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl302 b:16.8 occ:1.00 C27 A:8MS301 3.2 23.9 1.0 ND2 A:ASN40 3.2 11.7 1.0 NE1 A:TRP106 3.3 18.9 1.0 N A:PRO205 3.4 14.6 1.0 CA A:PRO205 3.6 16.6 1.0 C A:PHE204 3.7 16.4 1.0 CD A:PRO205 3.8 14.7 1.0 CB A:PHE204 3.8 13.2 1.0 CD1 A:TRP106 3.8 19.2 1.0 CB A:PRO205 3.9 15.3 1.0 CB A:ASN40 3.9 15.0 1.0 O A:PHE204 4.0 14.4 1.0 CG A:ASN40 4.1 14.9 1.0 CZ A:PHE167 4.1 18.6 1.0 CD1 A:LEU208 4.1 17.0 1.0 CG A:LEU208 4.2 19.2 1.0 CD2 A:LEU208 4.4 15.5 1.0 CG A:PRO205 4.4 15.5 1.0 CA A:PHE204 4.4 17.1 1.0 C26 A:8MS301 4.4 21.4 1.0 CE2 A:PHE148 4.5 18.1 1.0 CE2 A:TRP106 4.5 17.6 1.0 CE2 A:PHE167 4.6 15.8 1.0 C25 A:8MS301 4.7 23.3 1.0 C24 A:8MS301 4.8 23.3 1.0 CG A:PHE204 4.8 16.5 1.0 CE1 A:PHE167 4.9 17.7 1.0 C A:PRO205 5.0 14.5 1.0

P.K.Mishra, M.G.Kang, H.Lee, S.Kim, S.Choi, N.Sharma, C.M.Park, J.Ko, C.Lee, J.K.Seo, H.W.Rhee. A Chemical Tool For Blue Light-Inducible Proximity Photo-Crosslinking in Live Cells. Chem Sci V. 13 955 2022.
ISSN: ISSN 2041-6520
PubMed: 35211260
DOI: 10.1039/D1SC04871F