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Sodium in PDB 8rnx: Hen Egg White Lysozyme Soaked with [Hisq][Trans-RUCL4(Dmso)(Isq)]

Enzymatic activity of Hen Egg White Lysozyme Soaked with [Hisq][Trans-RUCL4(Dmso)(Isq)]

All present enzymatic activity of Hen Egg White Lysozyme Soaked with [Hisq][Trans-RUCL4(Dmso)(Isq)]:
3.2.1.17;

Protein crystallography data

The structure of Hen Egg White Lysozyme Soaked with [Hisq][Trans-RUCL4(Dmso)(Isq)], PDB code: 8rnx was solved by M.Oszajca, M.Flejszar, A.Szura, P.Drozdz, M.Brindell, K.Kurpiewska, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 19.16 / 1.25
Space group P 43 21 2
Cell size a, b, c (Å), α, β, γ (°) 78.993, 78.993, 37.002, 90, 90, 90
R / Rfree (%) 22.2 / 24.8

Other elements in 8rnx:

The structure of Hen Egg White Lysozyme Soaked with [Hisq][Trans-RUCL4(Dmso)(Isq)] also contains other interesting chemical elements:

Chlorine (Cl) 3 atoms
Ruthenium (Ru) 1 atom

Sodium Binding Sites:

The binding sites of Sodium atom in the Hen Egg White Lysozyme Soaked with [Hisq][Trans-RUCL4(Dmso)(Isq)] (pdb code 8rnx). This binding sites where shown within 5.0 Angstroms radius around Sodium atom.
In total 2 binding sites of Sodium where determined in the Hen Egg White Lysozyme Soaked with [Hisq][Trans-RUCL4(Dmso)(Isq)], PDB code: 8rnx:
Jump to Sodium binding site number: 1; 2;

Sodium binding site 1 out of 2 in 8rnx

Go back to Sodium Binding Sites List in 8rnx
Sodium binding site 1 out of 2 in the Hen Egg White Lysozyme Soaked with [Hisq][Trans-RUCL4(Dmso)(Isq)]


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 1 of Hen Egg White Lysozyme Soaked with [Hisq][Trans-RUCL4(Dmso)(Isq)] within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na202

b:20.6
occ:1.00
O A:SER60 2.4 19.5 1.0
O A:HOH348 2.4 23.2 1.0
O A:CYS64 2.4 18.7 1.0
O A:ARG73 2.4 22.0 1.0
O A:HOH334 2.4 19.9 1.0
OG A:SER72 2.5 21.9 1.0
CB A:SER72 3.3 18.6 1.0
C A:ARG73 3.5 21.8 1.0
C A:CYS64 3.5 17.5 1.0
C A:SER60 3.5 18.5 1.0
CA A:ASN65 3.9 20.8 1.0
N A:ARG73 3.9 23.5 1.0
CA A:SER60 4.1 18.0 1.0
C A:SER72 4.1 27.1 1.0
N A:ASN65 4.1 18.5 1.0
CB A:SER60 4.3 18.5 1.0
CA A:ARG73 4.3 23.0 1.0
CA A:SER72 4.3 23.5 1.0
N A:ASN74 4.4 21.8 1.0
N A:CYS64 4.5 17.5 1.0
CA A:ASN74 4.5 20.4 1.0
O A:ARG61 4.6 22.4 1.0
C A:ARG61 4.6 24.7 1.0
N A:ASP66 4.6 17.1 1.0
N A:ARG61 4.6 18.8 1.0
OD1 A:ASN65 4.6 21.3 1.0
CA A:CYS64 4.6 17.8 1.0
CB A:ASN74 4.7 22.6 1.0
O A:SER72 4.7 24.2 1.0
CL A:CL205 4.7 23.8 1.0
CB A:THR69 4.7 19.1 1.0
C A:ASN65 4.8 17.4 1.0
CB A:ASN65 4.8 21.2 1.0
CA A:ARG61 4.9 20.7 1.0
N A:TRP62 4.9 20.9 1.0

Sodium binding site 2 out of 2 in 8rnx

Go back to Sodium Binding Sites List in 8rnx
Sodium binding site 2 out of 2 in the Hen Egg White Lysozyme Soaked with [Hisq][Trans-RUCL4(Dmso)(Isq)]


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 2 of Hen Egg White Lysozyme Soaked with [Hisq][Trans-RUCL4(Dmso)(Isq)] within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na203

b:43.8
occ:1.00
O A:HOH341 2.3 47.4 1.0
O A:HOH379 2.4 40.1 1.0
NE2 A:HIS15 2.5 38.8 1.0
NH1 A:ARG14 2.6 48.5 1.0
O A:HOH381 2.9 25.8 1.0
CE1 A:HIS15 3.2 37.5 1.0
CD2 A:HIS15 3.6 29.6 1.0
CZ A:ARG14 3.7 47.8 1.0
OD1 A:ASP87 3.9 35.1 1.0
CD A:ARG14 4.3 44.1 1.0
ND1 A:HIS15 4.4 37.9 1.0
NE A:ARG14 4.4 50.4 1.0
NH2 A:ARG14 4.6 44.0 1.0
CG A:HIS15 4.6 31.2 1.0
OG1 A:THR89 4.7 30.2 1.0
CG A:ASP87 4.7 36.8 1.0

Reference:

M.Oszajca, M.Flejszar, A.Szura, P.Drozdz, M.Brindell, K.Kurpiewska. Exploring the Coordination Chemistry of Ruthenium Complexes with Lysozymes: Structural and in Solution Studies To Be Published.
Page generated: Wed Oct 9 13:21:18 2024

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