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Sodium in PDB 7p2h: Dimethylated Fusion Protein of Rsl and Mussel Adhesion Peptide (Mefp) in Complex with Cucurbit[7]Uril, H3 Sheet Assembly

Protein crystallography data

The structure of Dimethylated Fusion Protein of Rsl and Mussel Adhesion Peptide (Mefp) in Complex with Cucurbit[7]Uril, H3 Sheet Assembly, PDB code: 7p2h was solved by K.Ramberg, S.Engilberge, P.B.Crowley, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 43.63 / 2.15
Space group H 3
Cell size a, b, c (Å), α, β, γ (°) 51.023, 51.023, 275.902, 90, 90, 120
R / Rfree (%) 18.1 / 21.8

Sodium Binding Sites:

The binding sites of Sodium atom in the Dimethylated Fusion Protein of Rsl and Mussel Adhesion Peptide (Mefp) in Complex with Cucurbit[7]Uril, H3 Sheet Assembly (pdb code 7p2h). This binding sites where shown within 5.0 Angstroms radius around Sodium atom.
In total 2 binding sites of Sodium where determined in the Dimethylated Fusion Protein of Rsl and Mussel Adhesion Peptide (Mefp) in Complex with Cucurbit[7]Uril, H3 Sheet Assembly, PDB code: 7p2h:
Jump to Sodium binding site number: 1; 2;

Sodium binding site 1 out of 2 in 7p2h

Go back to Sodium Binding Sites List in 7p2h
Sodium binding site 1 out of 2 in the Dimethylated Fusion Protein of Rsl and Mussel Adhesion Peptide (Mefp) in Complex with Cucurbit[7]Uril, H3 Sheet Assembly


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 1 of Dimethylated Fusion Protein of Rsl and Mussel Adhesion Peptide (Mefp) in Complex with Cucurbit[7]Uril, H3 Sheet Assembly within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Na104

b:43.3
occ:0.33
O10 A:QQ7101 2.5 42.9 1.0
O07 A:QQ7101 2.5 39.5 1.0
C23 A:QQ7101 3.6 41.2 1.0
C21 A:QQ7101 3.6 40.7 1.0
C39 A:QQ7101 3.7 39.5 1.0
N17 A:QQ7101 4.1 39.1 1.0
N15 A:QQ7101 4.1 40.9 1.0
N20 A:QQ7101 4.8 41.3 1.0
N12 A:QQ7101 4.8 40.0 1.0

Sodium binding site 2 out of 2 in 7p2h

Go back to Sodium Binding Sites List in 7p2h
Sodium binding site 2 out of 2 in the Dimethylated Fusion Protein of Rsl and Mussel Adhesion Peptide (Mefp) in Complex with Cucurbit[7]Uril, H3 Sheet Assembly


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 2 of Dimethylated Fusion Protein of Rsl and Mussel Adhesion Peptide (Mefp) in Complex with Cucurbit[7]Uril, H3 Sheet Assembly within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Na104

b:41.2
occ:0.33
O B:QQ7101 2.5 43.6 1.0
O06 B:QQ7101 2.6 42.0 1.0
C35 B:QQ7101 3.6 41.3 1.0
C17 B:QQ7101 3.6 41.7 1.0
C41 B:QQ7101 3.6 39.7 1.0
O B:HOH202 3.9 43.5 1.0
N B:QQ7101 4.1 38.9 1.0
N14 B:QQ7101 4.1 39.4 1.0
N25 B:QQ7101 4.8 42.4 1.0
N09 B:QQ7101 4.9 41.5 1.0

Reference:

K.O.Ramberg, F.Guagnini, S.Engilberge, M.A.Wronska, M.L.Rennie, J.Perez, P.B.Crowley. Segregated Protein-Cucurbit[7]Uril Crystalline Architectures Via Modulatory Peptide Tectons. Chemistry 2021.
ISSN: ISSN 0947-6539
PubMed: 34432924
DOI: 10.1002/CHEM.202103025
Page generated: Tue Oct 8 18:26:20 2024

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