Bromine in PDB 4n6c: Crystal Structure of the B1RZQ2 Protein From Streptococcus Pneumoniae. Northeast Structural Genomics Consortium (Nesg) Target SPR36.

The structure of Crystal Structure of the B1RZQ2 Protein From Streptococcus Pneumoniae. Northeast Structural Genomics Consortium (Nesg) Target SPR36., PDB code: 4n6c was solved by S.Vorobiev, J.Seetharaman, D.Patel, R.Xiao, C.Ciccosanti, D.Wang, J.K.Everett, T.B.Acton, G.T.Montelione, L.Tong, J.F.Hunt, Northeaststructural Genomics Consortium (Nesg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	36.95 / 1.55
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	62.960, 36.078, 82.163, 90.00, 100.00, 90.00
R / Rfree (%)	20.1 / 21.9

The binding sites of Bromine atom in the Crystal Structure of the B1RZQ2 Protein From Streptococcus Pneumoniae. Northeast Structural Genomics Consortium (Nesg) Target SPR36. (pdb code 4n6c). This binding sites where shown within 5.0 Angstroms radius around Bromine atom.
In total 2 binding sites of Bromine where determined in the Crystal Structure of the B1RZQ2 Protein From Streptococcus Pneumoniae. Northeast Structural Genomics Consortium (Nesg) Target SPR36., PDB code: 4n6c:
Jump to Bromine binding site number: 1; 2;

Bromine binding site 1 out of 2 in the Crystal Structure of the B1RZQ2 Protein From Streptococcus Pneumoniae. Northeast Structural Genomics Consortium (Nesg) Target SPR36.


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 1 of Crystal Structure of the B1RZQ2 Protein From Streptococcus Pneumoniae. Northeast Structural Genomics Consortium (Nesg) Target SPR36. within 5.0Å range: probe atom residue distance (Å) B Occ A:Br201 b:25.8 occ:1.00 O A:HOH327 3.4 20.7 1.0 N A:ARG42 3.4 23.0 1.0 O A:HOH402 3.5 30.2 1.0 NH1 A:ARG42 3.6 22.0 1.0 CB A:ARG42 3.7 21.4 1.0 CG A:ARG42 3.8 19.7 1.0 CG A:LYS163 3.9 30.3 1.0 CD A:ARG42 3.9 19.2 1.0 CB A:LYS163 4.0 26.3 1.0 CB A:ASP41 4.0 28.2 1.0 N A:ASP41 4.1 25.4 1.0 CG1 A:VAL40 4.1 30.0 1.0 CA A:ARG42 4.1 20.3 1.0 CE2 A:PHE160 4.1 23.9 1.0 CA A:ASP41 4.3 25.2 1.0 C A:ASP41 4.3 26.7 1.0 CD2 A:PHE160 4.3 22.3 1.0 CD A:LYS163 4.6 43.1 1.0 CZ A:ARG42 4.7 22.0 1.0 NE A:ARG42 4.8 19.3 1.0 O A:ARG42 4.8 25.3 1.0 ND2 A:ASN47 4.8 18.9 1.0 O A:HOH444 4.9 32.3 1.0 C A:ARG42 5.0 21.7 1.0 C A:VAL40 5.0 28.6 1.0

Bromine binding site 2 out of 2 in the Crystal Structure of the B1RZQ2 Protein From Streptococcus Pneumoniae. Northeast Structural Genomics Consortium (Nesg) Target SPR36.


Mono view


Stereo pair view

A full contact list of Bromine with other atoms in the Br binding site number 2 of Crystal Structure of the B1RZQ2 Protein From Streptococcus Pneumoniae. Northeast Structural Genomics Consortium (Nesg) Target SPR36. within 5.0Å range: probe atom residue distance (Å) B Occ B:Br201 b:30.6 occ:1.00 O B:HOH371 3.3 26.3 1.0 N B:ARG42 3.5 29.0 1.0 CB B:ARG42 3.7 22.0 1.0 NH1 B:ARG42 3.7 28.7 1.0 CG B:ARG42 3.8 26.3 1.0 CG B:LYS163 3.9 29.8 1.0 CB B:LYS163 3.9 31.3 1.0 CD B:ARG42 4.0 26.6 1.0 N B:ASP41 4.1 30.7 1.0 CD B:LYS163 4.1 43.0 1.0 CB B:ASP41 4.1 35.8 1.0 CG1 B:VAL40 4.1 30.5 1.0 CA B:ARG42 4.2 25.3 1.0 CE2 B:PHE160 4.2 27.6 1.0 CD2 B:PHE160 4.4 24.1 1.0 CA B:ASP41 4.4 34.1 1.0 C B:ASP41 4.4 37.4 1.0 CZ B:ARG42 4.7 27.0 1.0 O B:ARG42 4.8 30.4 1.0 ND2 B:ASN47 4.8 19.3 1.0 NE B:ARG42 4.8 23.2 1.0 O B:HOH381 4.8 52.6 1.0 C B:VAL40 4.9 29.2 1.0 C B:ARG42 4.9 25.9 1.0 CE B:LYS163 5.0 44.7 1.0 CG B:ASP41 5.0 48.0 1.0

S.Vorobiev, J.Seetharaman, D.Patel, R.Xiao, C.Ciccosanti, D.Wang, J.K.Everett, T.B.Acton, G.T.Montelione, L.Tong, J.F.Hunt. Crystal Structure of the B1RZQ2 Protein From Streptococcus Pneumoniae. To Be Published.