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Sodium in PDB 5tpp: Crystal Structure of DH270.5 (Unliganded) From the DH270 Broadly Neutralizing N332-Glycan Dependent Lineage

Protein crystallography data

The structure of Crystal Structure of DH270.5 (Unliganded) From the DH270 Broadly Neutralizing N332-Glycan Dependent Lineage, PDB code: 5tpp was solved by D.Fera, S.C.Harrison, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 44.96 / 1.85
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 135.114, 68.798, 59.463, 90.00, 113.21, 90.00
R / Rfree (%) 17.9 / 21.2

Sodium Binding Sites:

The binding sites of Sodium atom in the Crystal Structure of DH270.5 (Unliganded) From the DH270 Broadly Neutralizing N332-Glycan Dependent Lineage (pdb code 5tpp). This binding sites where shown within 5.0 Angstroms radius around Sodium atom.
In total 3 binding sites of Sodium where determined in the Crystal Structure of DH270.5 (Unliganded) From the DH270 Broadly Neutralizing N332-Glycan Dependent Lineage, PDB code: 5tpp:
Jump to Sodium binding site number: 1; 2; 3;

Sodium binding site 1 out of 3 in 5tpp

Go back to Sodium Binding Sites List in 5tpp
Sodium binding site 1 out of 3 in the Crystal Structure of DH270.5 (Unliganded) From the DH270 Broadly Neutralizing N332-Glycan Dependent Lineage


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 1 of Crystal Structure of DH270.5 (Unliganded) From the DH270 Broadly Neutralizing N332-Glycan Dependent Lineage within 5.0Å range:
probe atom residue distance (Å) B Occ
L:Na301

b:79.5
occ:1.00
O L:ASP28 2.4 30.7 1.0
N L:PHE32 2.4 36.6 1.0
O L:HOH428 2.6 33.8 1.0
O L:HOH444 2.8 75.7 1.0
CB L:PHE32 2.9 39.8 1.0
CA L:PHE32 3.0 37.2 1.0
O L:PHE32 3.3 33.9 1.0
C L:PHE32 3.4 38.4 1.0
CD2 L:PHE32 3.5 45.7 1.0
CB L:LYS31 3.5 37.2 1.0
C L:LYS31 3.5 35.8 1.0
C L:ASP28 3.5 30.7 1.0
CG L:PHE32 3.6 44.0 1.0
CB L:PHE93 3.8 27.5 1.0
CA L:LYS31 3.8 37.5 1.0
O L:PHE93 3.9 26.9 1.0
N L:LYS31 4.0 38.4 1.0
OG L:SER92 4.1 23.8 1.0
O L:VAL29 4.1 39.1 1.0
CD1 L:PHE93 4.2 37.9 1.0
CA L:ASP28 4.3 29.6 1.0
CG L:PHE93 4.4 33.5 1.0
C L:VAL29 4.4 36.2 1.0
N L:VAL29 4.5 30.1 1.0
O L:HOH520 4.5 69.3 1.0
N L:ASP33 4.5 34.8 1.0
N L:LEU34 4.5 26.2 1.0
CG L:LYS31 4.6 39.6 1.0
CA L:VAL29 4.6 31.2 1.0
O L:LYS31 4.6 36.8 1.0
C L:PHE93 4.6 27.1 1.0
CB L:LEU34 4.6 24.1 1.0
CA L:PHE93 4.7 24.7 1.0
CE2 L:PHE32 4.7 46.5 1.0
N L:PHE93 4.8 23.6 1.0
C L:GLY30 4.9 44.4 1.0
CD1 L:PHE32 5.0 46.1 1.0

Sodium binding site 2 out of 3 in 5tpp

Go back to Sodium Binding Sites List in 5tpp
Sodium binding site 2 out of 3 in the Crystal Structure of DH270.5 (Unliganded) From the DH270 Broadly Neutralizing N332-Glycan Dependent Lineage


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 2 of Crystal Structure of DH270.5 (Unliganded) From the DH270 Broadly Neutralizing N332-Glycan Dependent Lineage within 5.0Å range:
probe atom residue distance (Å) B Occ
L:Na302

b:72.7
occ:1.00
NE2 L:GLN171 2.3 34.1 1.0
CG L:ASP142 2.4 37.1 1.0
OD2 L:ASP142 2.4 40.3 1.0
OD1 L:ASP142 2.5 41.5 1.0
ND2 L:ASN173 2.5 33.0 1.0
CA L:ASP142 3.2 25.0 1.0
CG L:ASN173 3.3 32.8 1.0
OD1 L:ASN173 3.3 32.3 1.0
CD L:GLN171 3.3 32.5 1.0
CB L:ASP142 3.3 29.5 1.0
OE1 L:GLN171 3.6 31.9 1.0
N L:ASP142 3.8 24.1 1.0
CB L:LYS175 3.9 28.6 1.0
CG L:LYS175 4.4 29.4 1.0
CD L:LYS175 4.4 30.5 1.0
C L:ASP142 4.4 25.0 1.0
CG L:GLN171 4.6 32.4 1.0
CB L:ASN173 4.7 32.8 1.0
CB L:GLN171 4.8 31.5 1.0
O L:ASP142 4.9 25.6 1.0
C L:SER141 4.9 17.3 1.0
CA L:LYS175 5.0 28.3 1.0

Sodium binding site 3 out of 3 in 5tpp

Go back to Sodium Binding Sites List in 5tpp
Sodium binding site 3 out of 3 in the Crystal Structure of DH270.5 (Unliganded) From the DH270 Broadly Neutralizing N332-Glycan Dependent Lineage


Mono view


Stereo pair view

A full contact list of Sodium with other atoms in the Na binding site number 3 of Crystal Structure of DH270.5 (Unliganded) From the DH270 Broadly Neutralizing N332-Glycan Dependent Lineage within 5.0Å range:
probe atom residue distance (Å) B Occ
L:Na303

b:70.9
occ:1.00
O L:HOH485 2.2 37.9 1.0
O L:PRO212 2.2 37.5 1.0
C L:PRO212 3.0 33.5 1.0
CA L:PRO212 3.2 28.4 1.0
O L:HOH540 3.4 46.7 1.0
NE1 L:TRP189 3.9 19.2 1.0
CB L:PRO212 4.0 29.4 1.0
CZ2 L:TRP189 4.1 20.5 1.0
N L:GLU214 4.1 50.3 1.0
O L:ALA211 4.2 27.3 1.0
N L:THR213 4.2 47.4 1.0
CE2 L:TRP189 4.4 18.9 1.0
N L:PRO212 4.5 25.1 1.0
CB L:GLU214 4.7 52.2 1.0
C L:ALA211 4.8 26.7 1.0
C L:THR213 4.8 52.3 1.0
CA L:THR213 4.8 52.5 1.0
CA L:GLU214 4.8 51.9 1.0

Reference:

M.Bonsignori, E.F.Kreider, D.Fera, R.R.Meyerhoff, T.Bradley, K.Wiehe, S.M.Alam, B.Aussedat, W.E.Walkowicz, K.K.Hwang, K.O.Saunders, R.Zhang, M.A.Gladden, A.Monroe, A.Kumar, S.M.Xia, M.Cooper, M.K.Louder, K.Mckee, R.T.Bailer, B.W.Pier, C.A.Jette, G.Kelsoe, W.B.Williams, L.Morris, J.Kappes, K.Wagh, G.Kamanga, M.S.Cohen, P.T.Hraber, D.C.Montefiori, A.Trama, H.X.Liao, T.B.Kepler, M.A.Moody, F.Gao, S.J.Danishefsky, J.R.Mascola, G.M.Shaw, B.H.Hahn, S.C.Harrison, B.T.Korber, B.F.Haynes. Staged Induction of Hiv-1 Glycan-Dependent Broadly Neutralizing Antibodies. Sci Transl Med V. 9 2017.
ISSN: ESSN 1946-6242
PubMed: 28298420
DOI: 10.1126/SCITRANSLMED.AAI7514
Page generated: Tue Dec 15 11:38:02 2020

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