Chlorine in PDB 1sfx: X-Ray Crystal Structure of Putative Hth Transcription Regulator From Archaeoglobus Fulgidus

The structure of X-Ray Crystal Structure of Putative Hth Transcription Regulator From Archaeoglobus Fulgidus, PDB code: 1sfx was solved by J.Osipiuk, T.Skarina, A.Savchenko, A.Edwards, M.Cymborowski, W.Minor, A.Joachimiak, Midwest Center For Structural Genomics (Mcsg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	40.00 / 1.55
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	64.265, 59.634, 63.498, 90.00, 90.11, 90.00
R / Rfree (%)	14.8 / 18.3

The binding sites of Chlorine atom in the X-Ray Crystal Structure of Putative Hth Transcription Regulator From Archaeoglobus Fulgidus (pdb code 1sfx). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 3 binding sites of Chlorine where determined in the X-Ray Crystal Structure of Putative Hth Transcription Regulator From Archaeoglobus Fulgidus, PDB code: 1sfx:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in the X-Ray Crystal Structure of Putative Hth Transcription Regulator From Archaeoglobus Fulgidus


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of X-Ray Crystal Structure of Putative Hth Transcription Regulator From Archaeoglobus Fulgidus within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl501 b:20.2 occ:1.00 OG A:SER20 2.9 15.5 0.7 O A:HOH600 3.2 31.0 1.0 OG A:SER20 3.2 15.1 0.3 N A:SER20 3.3 14.6 1.0 CB A:SER20 3.4 14.5 0.7 CB A:SER20 3.4 14.5 0.3 CE A:LYS18 3.6 27.4 0.7 CD A:PRO19 3.7 16.5 1.0 CB A:LYS18 3.9 20.3 0.7 CB A:LYS18 3.9 20.1 0.3 N A:PRO19 4.0 16.4 1.0 CA A:SER20 4.0 14.4 1.0 CB A:PRO19 4.1 15.8 1.0 O A:HOH582 4.2 29.1 1.0 CG A:PRO19 4.2 16.0 1.0 CZ A:PHE49 4.3 16.0 1.0 C A:PRO19 4.3 14.7 1.0 CG A:LYS18 4.3 22.4 0.7 O A:HOH671 4.3 44.2 1.0 CA A:PRO19 4.4 15.7 1.0 CD A:LYS18 4.5 24.5 0.3 C A:LYS18 4.5 18.2 1.0 NZ A:LYS18 4.5 29.3 0.7 CD A:LYS18 4.6 25.5 0.7 CA A:LYS18 4.6 19.7 1.0 O A:HOH656 4.7 41.1 1.0 CG A:LYS18 4.8 21.9 0.3 CE2 A:PHE49 4.9 15.8 1.0 O A:HOH649 5.0 40.8 1.0

Chlorine binding site 2 out of 3 in the X-Ray Crystal Structure of Putative Hth Transcription Regulator From Archaeoglobus Fulgidus


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of X-Ray Crystal Structure of Putative Hth Transcription Regulator From Archaeoglobus Fulgidus within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl502 b:17.0 occ:0.85 O A:HOH643 2.7 38.4 1.0 O A:HOH522 2.9 15.8 1.0 O A:HOH504 3.2 9.2 1.0 O A:HOH586 3.2 29.9 1.0 N A:SER37 3.4 9.1 1.0 OG A:SER37 3.6 9.7 1.0 CB A:SER37 3.7 9.6 1.0 N A:VAL36 3.8 8.0 1.0 CB A:ARG35 3.8 6.8 1.0 CB A:VAL36 3.9 8.3 1.0 CA A:VAL36 4.1 8.4 1.0 CA A:SER37 4.2 9.3 1.0 O A:HOH553 4.2 23.1 1.0 CD A:ARG35 4.2 7.1 1.0 C A:VAL36 4.2 8.7 1.0 CZ2 A:TRP72 4.4 10.7 1.0 O A:HOH610 4.4 33.0 1.0 C A:ARG35 4.4 7.5 1.0 CG A:ARG35 4.4 6.9 1.0 CA A:ARG35 4.5 7.0 1.0 CG2 A:VAL36 4.8 8.5 1.0 CG1 A:VAL36 4.8 8.8 1.0 CH2 A:TRP72 4.9 10.6 1.0 O A:HOH524 4.9 16.1 1.0

Chlorine binding site 3 out of 3 in the X-Ray Crystal Structure of Putative Hth Transcription Regulator From Archaeoglobus Fulgidus


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of X-Ray Crystal Structure of Putative Hth Transcription Regulator From Archaeoglobus Fulgidus within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl503 b:12.5 occ:0.83 O B:HOH670 2.9 38.9 1.0 O B:HOH510 3.0 11.4 1.0 O B:HOH523 3.1 15.3 1.0 N B:TYR75 3.3 10.4 1.0 CB B:TYR75 3.9 10.8 1.0 CA B:GLY74 4.0 11.6 1.0 CD2 B:TYR75 4.0 14.9 1.0 C B:GLY74 4.1 11.1 1.0 CA B:TYR75 4.1 10.3 1.0 CG2 B:VAL36 4.2 9.8 1.0 O B:HOH573 4.3 25.0 1.0 O B:TYR75 4.3 10.5 1.0 CG B:TYR75 4.4 12.1 1.0 C B:TYR75 4.7 10.1 1.0 CE2 B:TYR77 4.7 9.1 1.0 O B:HOH633 4.8 34.9 1.0 CB B:VAL36 4.9 8.6 1.0 O B:HOH518 4.9 14.5 1.0

J.Osipiuk, T.Skarina, A.Savchenko, A.Edwards, M.Cymborowski, W.Minor, A.Joachimiak. X-Ray Crystal Structure of Putative Hth Transcription Regulator From Archaeoglobus Fulgidus To Be Published.