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Magnesium in PDB 3sm4: Crystal Structure of the K131A Mutant of Lambda Exonuclease in Complex with A 5'-Phosphorylated 14-Mer/12-Mer Duplex and Magnesium

Enzymatic activity of Crystal Structure of the K131A Mutant of Lambda Exonuclease in Complex with A 5'-Phosphorylated 14-Mer/12-Mer Duplex and Magnesium

All present enzymatic activity of Crystal Structure of the K131A Mutant of Lambda Exonuclease in Complex with A 5'-Phosphorylated 14-Mer/12-Mer Duplex and Magnesium:
3.1.11.3;

Protein crystallography data

The structure of Crystal Structure of the K131A Mutant of Lambda Exonuclease in Complex with A 5'-Phosphorylated 14-Mer/12-Mer Duplex and Magnesium, PDB code: 3sm4 was solved by C.E.Bell, J.Zhang, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 67.89 / 1.88
Space group P 65
Cell size a, b, c (Å), α, β, γ (°) 78.391, 78.391, 247.534, 90.00, 90.00, 120.00
R / Rfree (%) 16 / 18.6

Other elements in 3sm4:

The structure of Crystal Structure of the K131A Mutant of Lambda Exonuclease in Complex with A 5'-Phosphorylated 14-Mer/12-Mer Duplex and Magnesium also contains other interesting chemical elements:

Chlorine (Cl) 2 atoms

Magnesium Binding Sites:

The binding sites of Magnesium atom in the Crystal Structure of the K131A Mutant of Lambda Exonuclease in Complex with A 5'-Phosphorylated 14-Mer/12-Mer Duplex and Magnesium (pdb code 3sm4). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 2 binding sites of Magnesium where determined in the Crystal Structure of the K131A Mutant of Lambda Exonuclease in Complex with A 5'-Phosphorylated 14-Mer/12-Mer Duplex and Magnesium, PDB code: 3sm4:
Jump to Magnesium binding site number: 1; 2;

Magnesium binding site 1 out of 2 in 3sm4

Go back to Magnesium Binding Sites List in 3sm4
Magnesium binding site 1 out of 2 in the Crystal Structure of the K131A Mutant of Lambda Exonuclease in Complex with A 5'-Phosphorylated 14-Mer/12-Mer Duplex and Magnesium


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Crystal Structure of the K131A Mutant of Lambda Exonuclease in Complex with A 5'-Phosphorylated 14-Mer/12-Mer Duplex and Magnesium within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mg227

b:15.8
occ:1.00
O E:HOH543 2.0 12.5 1.0
O B:LEU130 2.0 15.9 1.0
OP1 E:DG2 2.0 15.7 1.0
OE2 B:GLU129 2.2 19.6 1.0
O B:HOH550 2.2 10.6 1.0
OD2 B:ASP119 2.2 15.7 1.0
C B:LEU130 3.2 16.4 1.0
CD B:GLU129 3.2 19.5 1.0
P E:DG2 3.2 16.1 1.0
CG B:ASP119 3.3 16.3 1.0
OD1 B:ASP119 3.6 16.5 1.0
N B:LEU130 3.7 17.3 1.0
OP2 E:DG2 3.8 16.0 1.0
OE1 B:GLU129 3.8 21.2 1.0
O5' E:DG2 3.8 16.1 1.0
CA B:LEU130 4.0 16.9 1.0
MG E:MG15 4.0 20.3 1.0
C5' E:DG2 4.0 17.1 1.0
O B:HOH310 4.1 19.3 1.0
N B:ALA131 4.2 15.8 1.0
O E:HOH370 4.2 7.4 1.0
OP2 E:DC3 4.3 16.8 1.0
CG B:GLU129 4.3 18.7 1.0
CB B:LEU130 4.4 17.1 1.0
CA B:ALA131 4.4 15.6 1.0
OE1 B:GLU85 4.4 23.4 1.0
O3' E:DA1 4.5 16.2 1.0
CB B:ASP119 4.6 16.9 1.0
C B:GLU129 4.7 17.7 1.0

Magnesium binding site 2 out of 2 in 3sm4

Go back to Magnesium Binding Sites List in 3sm4
Magnesium binding site 2 out of 2 in the Crystal Structure of the K131A Mutant of Lambda Exonuclease in Complex with A 5'-Phosphorylated 14-Mer/12-Mer Duplex and Magnesium


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Crystal Structure of the K131A Mutant of Lambda Exonuclease in Complex with A 5'-Phosphorylated 14-Mer/12-Mer Duplex and Magnesium within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Mg15

b:20.3
occ:1.00
O B:HOH305 2.0 13.4 1.0
OD1 B:ASP119 2.1 16.5 1.0
O B:HOH277 2.2 8.4 1.0
O B:HOH310 2.3 19.3 1.0
OP1 E:DG2 2.4 15.7 1.0
O3' E:DA1 2.5 16.2 1.0
P E:DG2 3.0 16.1 1.0
CG B:ASP119 3.2 16.3 1.0
O B:HOH261 3.7 19.2 1.0
OD2 B:ASP119 3.7 15.7 1.0
C3' E:DA1 3.7 17.7 1.0
O B:SER117 3.8 16.8 1.0
C4' E:DA1 3.9 18.4 1.0
OE1 B:GLU85 3.9 23.4 1.0
MG B:MG227 4.0 15.8 1.0
O5' E:DG2 4.1 16.1 1.0
OP2 E:DG2 4.1 16.0 1.0
C5' E:DG2 4.2 17.1 1.0
O B:HOH550 4.2 10.6 1.0
O B:HOH485 4.3 14.0 1.0
CB B:ASP119 4.4 16.9 1.0
CA B:ASP119 4.5 17.3 1.0
N B:ASP119 4.5 17.0 1.0
OE1 B:GLU129 4.5 21.2 1.0
O4' E:DA1 4.5 19.2 1.0
CD B:GLU85 4.7 23.8 1.0
OE2 B:GLU129 4.8 19.6 1.0
C B:PRO118 4.8 17.2 1.0
O B:PRO118 4.9 17.1 1.0
O B:HOH259 4.9 8.2 1.0
C2' E:DA1 4.9 18.3 1.0
OE2 B:GLU85 4.9 27.1 1.0
O5' E:DA1 5.0 19.8 1.0

Reference:

J.Zhang, K.A.Mccabe, C.E.Bell. Crystal Structures of {Lambda} Exonuclease in Complex with Dna Suggest An Electrostatic Ratchet Mechanism For Processivity. Proc.Natl.Acad.Sci.Usa V. 108 11872 2011.
ISSN: ISSN 0027-8424
PubMed: 21730170
DOI: 10.1073/PNAS.1103467108
Page generated: Thu Aug 15 11:04:12 2024

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