Chlorine in PDB 6krg: Crystal Structure of Sfgfp Y182TMSIPHE

The structure of Crystal Structure of Sfgfp Y182TMSIPHE, PDB code: 6krg was solved by J.P.Sun, J.Y.Wang, Z.L.Zhu, Q.T.He, P.Xiao, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	29.72 / 1.40
Space group	I 41
Cell size a, b, c (Å), α, β, γ (°)	68.565, 68.565, 119.260, 90.00, 90.00, 90.00
R / Rfree (%)	14.8 / 17.3

The structure of Crystal Structure of Sfgfp Y182TMSIPHE also contains other interesting chemical elements:

Silicon	(Si)	1 atom
Sodium	(Na)	1 atom

The binding sites of Chlorine atom in the Crystal Structure of Sfgfp Y182TMSIPHE (pdb code 6krg). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the Crystal Structure of Sfgfp Y182TMSIPHE, PDB code: 6krg:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the Crystal Structure of Sfgfp Y182TMSIPHE


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 Sfgfp Y182TMSIPHE within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl303 b:50.4 occ:1.00 NA A:NA306 2.6 68.3 1.0 O A:HOH476 3.1 23.1 1.0 NE2 A:HIS139 3.1 21.9 1.0 CE A:LYS52 3.5 40.6 1.0 CA A:PRO54 3.6 16.9 1.0 CD A:LYS52 3.7 37.3 1.0 CD2 A:HIS139 3.9 18.7 1.0 O A:LEU53 3.9 17.1 1.0 CG A:LYS52 4.0 31.3 1.0 CE1 A:HIS139 4.0 18.5 1.0 CB A:PRO54 4.2 19.1 1.0 O A:PRO54 4.3 18.0 1.0 O A:HOH499 4.3 58.7 1.0 C A:PRO54 4.3 16.7 1.0 N A:PRO54 4.4 16.1 1.0 C A:LEU53 4.5 16.3 1.0 O A:HOH452 4.5 32.0 1.0 NZ A:LYS52 4.7 42.9 1.0 O A:HOH517 4.7 44.0 1.0 CB A:LYS52 4.9 24.8 1.0

Chlorine binding site 2 out of 3 in the Crystal Structure of Sfgfp Y182TMSIPHE


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of Crystal Structure of Sfgfp Y182TMSIPHE within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl304 b:17.0 occ:1.00 NH1 A:ARG215 3.3 16.0 1.0 CA A:THR49 3.7 14.3 1.0 CD A:ARG215 3.7 16.9 1.0 CB A:THR49 3.9 14.6 1.0 O A:THR49 4.0 18.5 1.0 O A:HOH431 4.0 32.5 1.0 CG2 A:THR49 4.0 16.3 1.0 CD1 A:ILE47 4.0 15.8 1.0 C A:THR49 4.3 16.5 1.0 CZ A:ARG215 4.3 15.4 1.0 NE A:ARG215 4.5 15.4 1.0 O A:CYS48 4.6 17.7 1.0 N A:THR49 4.9 14.3 1.0 CG A:ARG215 5.0 16.9 1.0

Chlorine binding site 3 out of 3 in the Crystal Structure of Sfgfp Y182TMSIPHE


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of Crystal Structure of Sfgfp Y182TMSIPHE within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl305 b:19.1 occ:1.00 O A:HOH501 3.0 29.5 1.0 O A:HOH550 3.1 24.7 1.0 O A:HOH485 3.1 20.3 1.0 N A:TRP57 3.2 13.3 1.0 O A:HOH506 3.5 27.3 1.0 CD1 A:TRP57 3.7 15.1 1.0 CD A:PRO58 3.8 14.0 1.0 CA A:PRO56 3.8 14.2 1.0 CB A:TRP57 3.8 14.3 1.0 C A:PRO56 4.0 13.4 1.0 CD1 A:TYR143 4.0 16.1 1.0 CA A:TRP57 4.1 13.2 1.0 CB A:PRO56 4.1 15.7 1.0 CG A:TRP57 4.1 14.5 1.0 O A:HOH520 4.2 43.5 1.0 O A:HOH552 4.4 18.4 1.0 CE1 A:TYR143 4.4 15.9 1.0 O A:HOH636 4.5 48.8 1.0 N A:PRO58 4.8 12.9 1.0 CG A:PRO58 4.9 14.6 1.0 NE1 A:TRP57 4.9 14.4 1.0 C A:TRP57 5.0 13.4 1.0

J.P.Sun, J.Y.Wang, Z.L.Zhu, Q.T.He, P.Xiao. Crystal Structure of Tmsiphers Complexed with Tmsi To Be Published.