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Manganese in PDB 6dpd: Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C

Enzymatic activity of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C

All present enzymatic activity of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C:
3.1.26.4;

Protein crystallography data

The structure of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C, PDB code: 6dpd 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) 19.84 / 1.46
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 81.324, 37.988, 61.323, 90.00, 96.32, 90.00
R / Rfree (%) 15.1 / 17.3

Other elements in 6dpd:

The structure of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C also contains other interesting chemical elements:

Potassium (K) 1 atom
Iodine (I) 5 atoms

Manganese Binding Sites:

The binding sites of Manganese atom in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C (pdb code 6dpd). This binding sites where shown within 5.0 Angstroms radius around Manganese atom.
In total 6 binding sites of Manganese where determined in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C, PDB code: 6dpd:
Jump to Manganese binding site number: 1; 2; 3; 4; 5; 6;

Manganese binding site 1 out of 6 in 6dpd

Go back to Manganese Binding Sites List in 6dpd
Manganese binding site 1 out of 6 in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mn201

b:20.4
occ:1.00
O A:HOH359 2.1 21.2 1.0
OD2 A:ASP71 2.1 17.9 1.0
OD1 A:ASP192 2.1 22.4 1.0
OP3 b:C5 2.1 24.3 1.0
O A:HOH321 2.2 19.3 1.0
OP1 b:C5 2.6 18.8 1.0
P b:C5 2.9 21.8 1.0
HA A:ASP192 3.0 28.3 1.0
CG A:ASP71 3.1 16.7 1.0
CG A:ASP192 3.2 24.6 1.0
HB2 A:ASP192 3.4 27.7 1.0
OD1 A:ASP71 3.5 16.8 1.0
H A:TYR193 3.5 29.6 1.0
CB A:ASP192 3.6 23.1 1.0
MN A:MN203 3.7 32.2 0.1
CA A:ASP192 3.7 23.6 1.0
MN A:MN202 3.8 19.4 1.0
NZ A:LYS196 3.9 25.8 0.8
O5' b:C5 4.0 20.0 1.0
OP2 b:C5 4.0 21.4 1.0
OD2 A:ASP132 4.0 27.9 1.0
OP2 b:G6 4.0 21.4 1.0
O B:HOH207 4.0 26.1 1.0
HG22 A:ILE189 4.1 24.9 1.0
O A:VAL72 4.1 19.8 1.0
OE2 A:GLU188 4.2 32.5 1.0
C5' b:C5 4.2 23.5 1.0
N A:TYR193 4.2 24.7 1.0
OD2 A:ASP192 4.3 25.9 1.0
CB A:ASP71 4.4 15.9 1.0
HD1 A:TYR193 4.5 27.3 1.0
HB3 A:ASP192 4.6 27.7 1.0
C A:ASP192 4.6 25.2 1.0
HG21 A:ILE189 4.7 24.9 1.0
CG2 A:ILE189 4.7 20.8 1.0
N A:ASP192 4.8 21.9 1.0
K A:K206 4.8 34.0 0.6
HG23 A:ILE189 4.9 24.9 1.0
HB2 A:TYR193 4.9 30.6 1.0

Manganese binding site 2 out of 6 in 6dpd

Go back to Manganese Binding Sites List in 6dpd
Manganese binding site 2 out of 6 in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 2 of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mn202

b:19.4
occ:1.00
OP1 b:C5 2.0 18.8 1.0
OD1 A:ASP71 2.0 16.8 1.0
OD1 A:ASP132 2.1 20.5 1.0
OE1 A:GLU109 2.1 18.2 1.0
OD2 A:ASP132 2.5 27.9 1.0
CG A:ASP132 2.6 21.3 1.0
CD A:GLU109 3.0 19.2 1.0
CG A:ASP71 3.1 16.7 1.0
O A:HOH352 3.2 18.6 1.0
OE2 A:GLU109 3.3 20.1 1.0
P b:C5 3.4 21.8 1.0
OD2 A:ASP71 3.5 17.9 1.0
HG12 A:VAL72 3.6 23.2 1.0
C3' B:U4 3.6 23.7 1.0
O3' B:U4 3.6 24.0 1.0
H A:VAL72 3.8 20.8 1.0
MN A:MN201 3.8 20.4 1.0
O A:HOH359 4.0 21.2 1.0
C5' b:C5 4.1 23.5 1.0
CB A:ASP132 4.1 21.1 1.0
H A:ASP132 4.1 21.5 1.0
O5' b:C5 4.2 20.0 1.0
OP2 b:C5 4.2 21.4 1.0
HB2 A:SER133 4.3 24.9 1.0
CB A:ASP71 4.3 15.9 1.0
OP3 b:C5 4.3 24.3 1.0
HG21 A:ILE189 4.4 24.9 1.0
CG A:GLU109 4.4 16.6 1.0
CG1 A:VAL72 4.5 19.4 1.0
N A:VAL72 4.5 17.3 1.0
HB3 A:ASP132 4.6 25.3 1.0
HB2 A:ASP132 4.6 25.3 1.0
C4' B:U4 4.6 22.8 1.0
CA A:ASP71 4.6 15.7 1.0
HG3 A:GLU109 4.6 19.9 1.0
C2' B:U4 4.7 21.2 1.0
HG2 A:GLU109 4.7 19.9 1.0
C5' B:U4 4.8 23.0 1.0
CA A:ASP132 4.8 19.9 1.0
N A:ASP132 4.8 17.9 1.0
HG13 A:VAL72 4.8 23.2 1.0
HG22 A:ILE189 4.8 24.9 1.0
C A:ASP132 4.9 19.0 1.0
O2' B:U4 4.9 24.7 1.0
HG11 A:VAL72 4.9 23.2 1.0
O A:VAL72 4.9 19.8 1.0
O A:HOH321 4.9 19.3 1.0

Manganese binding site 3 out of 6 in 6dpd

Go back to Manganese Binding Sites List in 6dpd
Manganese binding site 3 out of 6 in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 3 of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mn203

b:32.2
occ:0.15
OP3 b:C5 2.1 24.3 1.0
CG A:LYS196 2.3 32.2 0.8
CD A:LYS196 2.4 30.4 0.8
NZ A:LYS196 2.4 25.8 0.8
OP2 b:G6 2.5 21.4 1.0
O B:HOH207 2.7 26.1 1.0
CE A:LYS196 2.9 27.2 0.8
P b:C5 3.2 21.8 1.0
O5' b:C5 3.4 20.0 1.0
CB A:LYS196 3.6 36.3 0.8
O5' b:G6 3.6 23.1 1.0
P b:G6 3.7 22.2 1.0
OD1 A:ASP192 3.7 22.4 1.0
MN A:MN201 3.7 20.4 1.0
O A:HOH321 3.8 19.3 1.0
OP2 b:C5 3.8 21.4 1.0
O A:HOH378 3.9 28.5 1.0
C5' b:C5 4.1 23.5 1.0
C3' b:C5 4.2 20.2 1.0
N A:LYS196 4.3 33.7 0.8
OP1 b:C5 4.4 18.8 1.0
O3' b:C5 4.4 20.7 1.0
CA A:LYS196 4.5 37.3 0.8
C4' b:C5 4.7 21.6 1.0
CG A:ASP192 4.7 24.6 1.0
O A:HOH359 4.8 21.2 1.0
OP1 b:G6 4.9 21.6 1.0
C6 b:C5 4.9 21.1 1.0
C5' b:G6 5.0 24.3 1.0
C A:ARG195 5.0 35.2 1.0

Manganese binding site 4 out of 6 in 6dpd

Go back to Manganese Binding Sites List in 6dpd
Manganese binding site 4 out of 6 in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 4 of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mn204

b:27.4
occ:0.60
OE1 A:GLU166 2.1 27.7 1.0
O A:HOH415 2.2 39.3 1.0
O A:HOH346 2.4 37.0 1.0
OD1 A:ASP163 2.5 29.4 1.0
CD A:GLU166 3.1 39.1 1.0
HA A:ASP163 3.4 23.2 1.0
OE2 A:GLU166 3.5 25.6 1.0
CG A:ASP163 3.5 29.9 1.0
NH2 A:ARG151 4.0 35.5 1.0
O A:HOH384 4.2 38.6 1.0
NZ A:LYS144 4.2 67.8 1.0
CA A:ASP163 4.2 19.4 1.0
HB2 A:GLU166 4.2 24.3 1.0
CB A:ASP163 4.2 24.3 1.0
HZ3 A:TRP159 4.2 31.2 1.0
HB3 A:ASP163 4.3 29.2 1.0
OD2 A:ASP163 4.4 28.6 1.0
CG A:GLU166 4.4 24.1 1.0
HG12 A:VAL162 4.5 27.5 1.0
CB A:GLU166 4.7 20.2 1.0
HB3 A:GLU166 4.7 24.3 1.0
HG3 A:GLU166 4.8 28.9 1.0
N A:ASP163 4.9 18.4 1.0
HE3 A:TRP159 5.0 28.1 1.0

Manganese binding site 5 out of 6 in 6dpd

Go back to Manganese Binding Sites List in 6dpd
Manganese binding site 5 out of 6 in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 5 of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mn205

b:35.5
occ:0.50
O A:LYS196 2.2 46.8 0.8
O A:HOH392 3.0 56.9 1.0
O A:HOH314 3.3 56.7 1.0
C A:LYS196 3.4 35.6 0.8
OXT A:LYS196 3.9 47.2 0.8
MN B:MN101 4.1 50.0 0.6
CA A:LYS196 4.6 37.3 0.8

Manganese binding site 6 out of 6 in 6dpd

Go back to Manganese Binding Sites List in 6dpd
Manganese binding site 6 out of 6 in the Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 6 of Crystal Structure of Bacillus Halodurans Ribonuclease H1 in Complex with An Rna/Dna Hybrid: Reaction in 16 Mm MN2+ and 200 Mm K+ For 40 S at 21 C within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mn101

b:50.0
occ:0.60
O B:HOH212 2.5 52.6 1.0
O A:HOH314 2.6 56.7 1.0
O6 b:G6 2.7 35.4 1.0
O B:HOH210 2.8 55.9 1.0
N7 b:G6 3.6 32.0 1.0
C6 b:G6 3.6 29.6 1.0
C5 b:G6 3.9 28.1 1.0
MN A:MN205 4.1 35.5 0.5
O A:LYS196 4.1 46.8 0.8
O B:HOH213 4.6 33.8 1.0
N4 C:DC1 4.6 30.1 1.0
CB A:LYS196 4.8 36.3 0.8
C8 b:G6 4.8 28.4 1.0
N4 b:C5 4.8 29.9 1.0
N1 b:G6 4.9 30.8 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: Sun Oct 6 04:06:46 2024

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