Chlorine in PDB 4hnh: The Crystal Structure of A Short-Chain Dehydrogenases/Reductase (Wide Type) From Veillonella Parvula Dsm 2008 in Complex with Nadp

The structure of The Crystal Structure of A Short-Chain Dehydrogenases/Reductase (Wide Type) From Veillonella Parvula Dsm 2008 in Complex with Nadp, PDB code: 4hnh was solved by K.Tan, C.Hatzos-Skintges, S.Clancy, A.Joachimiak, Midwest Center Forstructural Genomics (Mcsg), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	29.00 / 1.58
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	109.219, 71.687, 65.016, 90.00, 121.44, 90.00
R / Rfree (%)	17.5 / 20.3

The binding sites of Chlorine atom in the The Crystal Structure of A Short-Chain Dehydrogenases/Reductase (Wide Type) From Veillonella Parvula Dsm 2008 in Complex with Nadp (pdb code 4hnh). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 2 binding sites of Chlorine where determined in the The Crystal Structure of A Short-Chain Dehydrogenases/Reductase (Wide Type) From Veillonella Parvula Dsm 2008 in Complex with Nadp, PDB code: 4hnh:
Jump to Chlorine binding site number: 1; 2;

Chlorine binding site 1 out of 2 in the The Crystal Structure of A Short-Chain Dehydrogenases/Reductase (Wide Type) From Veillonella Parvula Dsm 2008 in Complex with Nadp


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of The Crystal Structure of A Short-Chain Dehydrogenases/Reductase (Wide Type) From Veillonella Parvula Dsm 2008 in Complex with Nadp within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl302 b:49.2 occ:1.00 N A:GLU55 3.0 18.9 1.0 NZ A:LYS63 3.4 53.9 1.0 CA A:ILE54 3.7 17.9 1.0 C A:ILE54 3.8 18.3 1.0 CB A:GLU55 3.9 23.0 1.0 CA A:GLU55 3.9 21.5 1.0 O A:GLU55 4.0 26.0 1.0 CG2 A:ILE54 4.1 18.1 1.0 CG A:GLU55 4.2 23.6 1.0 CE A:LYS38 4.3 47.5 1.0 O A:VAL53 4.3 21.5 1.0 C A:GLU55 4.5 25.5 1.0 CB A:ILE54 4.5 20.1 1.0 CE A:LYS63 4.7 52.1 1.0 OE1 A:GLU55 4.7 27.4 1.0 N A:ILE54 4.8 18.3 1.0 NZ A:LYS38 5.0 49.6 1.0 C A:VAL53 5.0 20.7 1.0 CD A:GLU55 5.0 27.2 1.0 CG1 A:ILE54 5.0 22.0 1.0

Chlorine binding site 2 out of 2 in the The Crystal Structure of A Short-Chain Dehydrogenases/Reductase (Wide Type) From Veillonella Parvula Dsm 2008 in Complex with Nadp


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of The Crystal Structure of A Short-Chain Dehydrogenases/Reductase (Wide Type) From Veillonella Parvula Dsm 2008 in Complex with Nadp within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl303 b:23.4 occ:1.00 O B:HOH506 2.8 26.7 1.0 OG B:SER202 2.8 18.4 1.0 O B:HOH613 3.1 40.8 1.0 CD B:ARG136 3.2 24.3 1.0 CG B:ARG136 3.3 20.4 1.0 NH1 B:ARG140 3.4 16.3 1.0 CB B:SER202 3.6 17.0 1.0 CD B:ARG140 3.9 11.7 1.0 CG2 B:ILE148 4.0 12.7 1.0 CD B:ARG150 4.0 17.9 1.0 CD1 B:ILE148 4.1 13.3 1.0 CG B:ARG150 4.2 16.9 1.0 CZ B:ARG140 4.3 16.6 1.0 CB B:ARG136 4.4 18.4 1.0 NE B:ARG150 4.5 18.7 1.0 CB B:ILE148 4.5 12.0 1.0 NE B:ARG140 4.5 12.2 1.0 NE B:ARG136 4.6 23.5 1.0 O B:HOH485 4.8 36.4 1.0 CG1 B:ILE148 4.9 13.0 1.0 CA B:SER202 4.9 15.6 1.0 OG B:SER104 5.0 16.2 0.3

K.Tan, C.Hatzos-Skintges, S.Clancy, A.Joachimiak. The Crystal Structure of A Short-Chain Dehydrogenases/Reductase (Wide Type) From Veillonella Parvula Dsm 2008 in Complex with Nadp. To Be Published.