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Manganese in PDB 1s1a: Pterocarpus Angolensis Seed Lectin (Pal) with One Binding Site Free and One Binding Site Containing the Disaccharide Man(A1-3)Manme

Protein crystallography data

The structure of Pterocarpus Angolensis Seed Lectin (Pal) with One Binding Site Free and One Binding Site Containing the Disaccharide Man(A1-3)Manme, PDB code: 1s1a was solved by L.Buts, A.Imberty, L.Wyns, S.Beeckmans, R.Loris, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 25.00 / 1.80
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 56.868, 83.212, 123.230, 90.00, 90.00, 90.00
R / Rfree (%) 18.5 / 20.5

Other elements in 1s1a:

The structure of Pterocarpus Angolensis Seed Lectin (Pal) with One Binding Site Free and One Binding Site Containing the Disaccharide Man(A1-3)Manme also contains other interesting chemical elements:

Calcium (Ca) 2 atoms

Manganese Binding Sites:

The binding sites of Manganese atom in the Pterocarpus Angolensis Seed Lectin (Pal) with One Binding Site Free and One Binding Site Containing the Disaccharide Man(A1-3)Manme (pdb code 1s1a). This binding sites where shown within 5.0 Angstroms radius around Manganese atom.
In total 2 binding sites of Manganese where determined in the Pterocarpus Angolensis Seed Lectin (Pal) with One Binding Site Free and One Binding Site Containing the Disaccharide Man(A1-3)Manme, PDB code: 1s1a:
Jump to Manganese binding site number: 1; 2;

Manganese binding site 1 out of 2 in 1s1a

Go back to Manganese Binding Sites List in 1s1a
Manganese binding site 1 out of 2 in the Pterocarpus Angolensis Seed Lectin (Pal) with One Binding Site Free and One Binding Site Containing the Disaccharide Man(A1-3)Manme


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 1 of Pterocarpus Angolensis Seed Lectin (Pal) with One Binding Site Free and One Binding Site Containing the Disaccharide Man(A1-3)Manme within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mn271

b:17.0
occ:1.00
OE1 A:GLU128 2.2 15.9 1.0
O A:HOH301 2.2 20.8 1.0
OD1 A:ASP141 2.2 15.6 1.0
OD2 A:ASP130 2.2 16.8 1.0
O A:HOH302 2.3 17.3 1.0
NE2 A:HIS146 2.3 16.3 1.0
CG A:ASP141 3.2 16.5 1.0
CD A:GLU128 3.2 17.2 1.0
CE1 A:HIS146 3.2 19.8 1.0
CG A:ASP130 3.2 14.3 1.0
CD2 A:HIS146 3.4 14.9 1.0
CB A:ASP130 3.6 13.1 1.0
OE2 A:GLU128 3.6 20.6 1.0
OD2 A:ASP141 3.6 20.5 1.0
O A:HOH303 3.9 17.6 1.0
CA A:CA272 4.2 17.3 1.0
OG A:SER156 4.3 16.7 1.0
OD1 A:ASP130 4.3 17.2 1.0
CB A:ASP141 4.4 17.2 1.0
ND1 A:HIS146 4.4 18.0 1.0
CG A:HIS146 4.5 17.6 1.0
CG A:GLU128 4.5 12.9 1.0
O A:ILE154 4.5 20.0 1.0
CD1 A:TRP140 4.6 16.6 1.0
O A:HOH328 4.6 21.8 1.0
NE1 A:TRP140 4.6 19.8 1.0
CA A:ASP141 4.8 21.9 1.0
CD A:PRO142 4.9 18.7 1.0

Manganese binding site 2 out of 2 in 1s1a

Go back to Manganese Binding Sites List in 1s1a
Manganese binding site 2 out of 2 in the Pterocarpus Angolensis Seed Lectin (Pal) with One Binding Site Free and One Binding Site Containing the Disaccharide Man(A1-3)Manme


Mono view


Stereo pair view

A full contact list of Manganese with other atoms in the Mn binding site number 2 of Pterocarpus Angolensis Seed Lectin (Pal) with One Binding Site Free and One Binding Site Containing the Disaccharide Man(A1-3)Manme within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mn273

b:16.2
occ:1.00
OD1 B:ASP141 2.2 15.8 1.0
OE1 B:GLU128 2.2 13.5 1.0
OD2 B:ASP130 2.2 13.8 1.0
O B:HOH306 2.2 16.5 1.0
O B:HOH305 2.2 18.1 1.0
NE2 B:HIS146 2.4 18.2 1.0
CG B:ASP141 3.2 19.0 1.0
CD B:GLU128 3.2 18.2 1.0
CG B:ASP130 3.2 16.8 1.0
CE1 B:HIS146 3.3 16.4 1.0
CD2 B:HIS146 3.4 13.1 1.0
OE2 B:GLU128 3.5 14.9 1.0
CB B:ASP130 3.6 17.2 1.0
OD2 B:ASP141 3.6 19.9 1.0
O B:HOH307 3.8 16.5 1.0
CA B:CA274 4.2 17.5 1.0
OG B:SER156 4.3 16.7 1.0
OD1 B:ASP130 4.3 15.7 1.0
CB B:ASP141 4.3 15.7 1.0
ND1 B:HIS146 4.4 17.6 1.0
O B:HOH330 4.5 24.0 1.0
CG B:HIS146 4.5 14.7 1.0
NE1 B:TRP140 4.5 18.4 1.0
O B:ILE154 4.5 19.9 1.0
CD1 B:TRP140 4.5 22.0 1.0
CG B:GLU128 4.5 15.2 1.0
CA B:ASP141 4.8 17.8 1.0
CD B:PRO142 4.9 23.9 1.0

Reference:

L.Buts, A.Imberty, L.Wyns, S.Beeckmans, R.Loris. N/A N/A.
Page generated: Tue Dec 15 03:55:19 2020

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