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Chlorine in PDB 6dpl: Crystal Structure of Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C

Enzymatic activity of Crystal Structure of Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C

All present enzymatic activity of Crystal Structure of Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C:
3.1.26.4;

Protein crystallography data

The structure of Crystal Structure of Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C, PDB code: 6dpl was solved by N.L.Samara, W.Yang, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 19.50 / 1.45
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 81.856, 37.521, 62.706, 90.00, 97.31, 90.00
R / Rfree (%) 15.1 / 17.9

Other elements in 6dpl:

The structure of Crystal Structure of Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C also contains other interesting chemical elements:

Rubidium (Rb) 6 atoms
Magnesium (Mg) 2 atoms

Chlorine Binding Sites:

The binding sites of Chlorine atom in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C (pdb code 6dpl). 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 Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C, PDB code: 6dpl:
Jump to Chlorine binding site number: 1; 2; 3;

Chlorine binding site 1 out of 3 in 6dpl

Go back to Chlorine Binding Sites List in 6dpl
Chlorine binding site 1 out of 3 in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C


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 Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl207

b:35.3
occ:0.75
HH A:TYR83 2.2 27.7 1.0
HD22 A:LEU111 3.0 20.0 1.0
OH A:TYR83 3.0 23.1 1.0
O A:HOH374 3.0 32.9 1.0
HB3 A:LEU111 3.2 15.8 1.0
HD13 A:LEU111 3.2 22.3 1.0
HD22 A:LEU161 3.2 29.5 1.0
HE2 A:TYR83 3.3 24.4 1.0
HD13 A:LEU161 3.3 25.4 1.0
HB3 A:LEU161 3.3 19.6 1.0
O A:HOH344 3.5 20.1 1.0
C3 A:GOL213 3.6 64.8 1.0
HD3 A:ARG97 3.8 29.5 1.0
CD2 A:LEU111 3.9 16.7 1.0
CZ A:TYR83 3.9 20.1 1.0
CE2 A:TYR83 3.9 20.4 1.0
CB A:LEU111 4.0 13.2 1.0
CD1 A:LEU111 4.0 18.6 1.0
CD2 A:LEU161 4.1 24.6 1.0
CD1 A:LEU161 4.2 21.2 1.0
O3 A:GOL213 4.2 62.4 1.0
CB A:LEU161 4.2 16.3 1.0
CG A:LEU111 4.2 13.7 1.0
HH11 A:ARG97 4.2 52.5 1.0
CG A:LEU161 4.4 18.9 1.0
HD21 A:LEU111 4.4 20.0 1.0
HD23 A:LEU111 4.5 20.0 1.0
O A:HOH363 4.5 24.6 1.0
HB2 A:HIS115 4.5 17.8 1.0
HD11 A:LEU111 4.5 22.3 1.0
HG2 A:ARG97 4.6 28.6 1.0
HB2 A:LEU111 4.6 15.8 1.0
HD12 A:LEU111 4.7 22.3 1.0
HD21 A:LEU161 4.7 29.5 1.0
O A:HOH304 4.7 36.0 1.0
HD11 A:LEU161 4.7 25.4 1.0
HD23 A:LEU161 4.7 29.5 1.0
HB2 A:LEU161 4.7 19.6 1.0
NH1 A:ARG97 4.7 43.8 1.0
CD A:ARG97 4.7 24.6 1.0
HD12 A:LEU161 4.8 25.4 1.0
HA A:LEU111 4.8 16.2 1.0
O A:LEU111 4.9 13.8 1.0
C2 A:GOL213 4.9 67.5 1.0
ND1 A:HIS115 4.9 34.1 1.0
HD11 A:ILE100 4.9 28.5 1.0
CA A:LEU111 4.9 13.5 1.0
HB2 A:ALA165 5.0 18.4 1.0
O2 A:GOL213 5.0 68.3 1.0

Chlorine binding site 2 out of 3 in 6dpl

Go back to Chlorine Binding Sites List in 6dpl
Chlorine binding site 2 out of 3 in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C


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 Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl208

b:44.8
occ:0.60
O A:HOH351 3.0 25.1 1.0
HD3 A:LYS180 3.0 36.2 1.0
O A:HOH427 3.0 41.4 1.0
HA A:GLN134 3.1 22.1 1.0
HG3 A:GLN134 3.2 31.4 1.0
HB2 A:LYS180 3.2 26.9 1.0
HD12 A:ILE137 3.4 22.3 1.0
HG21 A:ILE137 3.8 27.5 1.0
O A:HOH319 3.8 32.1 1.0
HB A:ILE137 3.8 19.4 1.0
HD13 A:ILE137 3.9 22.3 1.0
CD A:LYS180 3.9 30.1 1.0
CA A:GLN134 4.0 18.4 1.0
CD1 A:ILE137 4.1 18.6 1.0
CG A:GLN134 4.1 26.2 1.0
CB A:LYS180 4.1 22.4 1.0
HG2 A:LYS180 4.1 35.0 1.0
CG A:LYS180 4.3 29.1 1.0
HB2 A:GLN134 4.3 25.1 1.0
CB A:GLN134 4.4 20.9 1.0
CG2 A:ILE137 4.4 22.9 1.0
HG2 A:GLN134 4.5 31.4 1.0
CB A:ILE137 4.5 16.1 1.0
HE3 A:LYS180 4.5 35.6 1.0
HG22 A:ILE137 4.5 27.5 1.0
HD2 A:LYS180 4.5 36.2 1.0
HE21 A:GLN134 4.6 29.2 1.0
O A:GLN134 4.6 18.3 1.0
HB3 A:LYS180 4.6 26.9 1.0
O A:HOH426 4.6 38.6 1.0
CE A:LYS180 4.7 29.7 1.0
HE2 A:LYS180 4.7 35.6 1.0
HD11 A:ILE137 4.8 22.3 1.0
C A:GLN134 4.8 18.6 1.0
CG1 A:ILE137 4.9 15.1 1.0
HA A:LYS180 4.9 21.6 1.0
N A:GLN134 5.0 16.6 1.0
O A:HOH415 5.0 30.5 1.0

Chlorine binding site 3 out of 3 in 6dpl

Go back to Chlorine Binding Sites List in 6dpl
Chlorine binding site 3 out of 3 in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C


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 Bacillus Halodurans Ribonuclease H1 K196A in Complex with An Rna/Dna Hybrid: Reaction in 10 Mm MG2+ and 200 Mm Rb+ For 720 S at 21 C within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Cl209

b:53.6
occ:0.75
O A:HOH430 2.8 41.2 0.8
O A:HOH429 2.9 34.4 1.0
HG3 A:PRO128 3.3 28.4 1.0
HD11 A:LEU179 3.3 24.7 1.0
HB3 A:PRO128 3.4 20.9 1.0
CG A:PRO177 3.6 20.9 1.0
CD1 A:ILE64 3.8 42.2 1.0
HD21 A:LEU179 3.8 29.7 1.0
CB A:PRO177 3.8 17.5 1.0
CG A:PRO128 4.0 23.7 1.0
CB A:PRO128 4.1 17.4 1.0
O A:HOH431 4.2 63.6 1.0
CD1 A:LEU179 4.2 20.6 1.0
HD3 A:PRO128 4.3 20.6 1.0
HB2 A:PRO128 4.5 20.9 1.0
HD13 A:LEU179 4.6 24.7 1.0
CD2 A:LEU179 4.7 24.8 1.0
HD12 A:LEU179 4.7 24.7 1.0
CD A:PRO128 4.8 17.2 1.0
HG2 A:PRO128 4.8 28.4 1.0
CD A:PRO177 4.8 18.9 1.0
HG A:LEU179 4.9 25.4 1.0
CG A:LEU179 4.9 21.2 1.0
HD22 A:LEU179 5.0 29.7 1.0

Reference:

N.L.Samara, W.Yang. Cation Trafficking Propels Rna Hydrolysis. Nat. Struct. Mol. Biol. V. 25 715 2018.
ISSN: ESSN 1545-9985
PubMed: 30076410
DOI: 10.1038/S41594-018-0099-4
Page generated: Sat Jul 27 21:45:42 2024

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