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Calcium in PDB 2w08: The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine

Protein crystallography data

The structure of The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine, PDB code: 2w08 was solved by S.E.Kolstoe, M.B.Pepys, S.P.Wood, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 47.48 / 1.70
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 94.769, 69.435, 102.063, 90.00, 97.05, 90.00
R / Rfree (%) 15.4 / 17.6

Calcium Binding Sites:

The binding sites of Calcium atom in the The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine (pdb code 2w08). This binding sites where shown within 5.0 Angstroms radius around Calcium atom.
In total 10 binding sites of Calcium where determined in the The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine, PDB code: 2w08:
Jump to Calcium binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Calcium binding site 1 out of 10 in 2w08

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Calcium binding site 1 out of 10 in the The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 1 of The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca205

b:15.1
occ:1.00
O1P A:TPO500 2.4 15.9 1.0
OD1 A:ASN59 2.4 15.0 1.0
O A:GLN137 2.5 15.2 1.0
OD1 A:ASP138 2.5 16.9 1.0
OE2 A:GLU136 2.5 11.5 1.0
OD1 A:ASP58 2.5 18.7 1.0
OE1 A:GLU136 2.7 16.7 1.0
OD2 A:ASP58 2.7 17.2 1.0
CD A:GLU136 2.9 17.1 1.0
CG A:ASP58 2.9 18.5 1.0
CG A:ASN59 3.4 13.7 1.0
C A:GLN137 3.5 18.5 1.0
CG A:ASP138 3.7 18.1 1.0
ND2 A:ASN59 3.7 11.6 1.0
P A:TPO500 3.7 18.8 1.0
CA A:ASP138 3.8 19.3 1.0
CA A:CA206 3.9 15.1 1.0
O2P A:TPO500 4.1 16.1 1.0
N A:ASP138 4.1 16.2 1.0
O A:HOH2085 4.1 13.1 1.0
O A:HOH2101 4.3 21.8 1.0
CB A:ASP138 4.4 14.3 1.0
N A:ASN59 4.4 15.6 1.0
CG A:GLU136 4.4 12.3 1.0
CB A:ASP58 4.4 20.5 1.0
O3P A:TPO500 4.4 19.7 1.0
OD2 A:ASP138 4.6 16.3 1.0
CB A:ASN59 4.7 12.2 1.0
CA A:GLN137 4.7 13.9 1.0
N A:GLN137 4.7 11.2 1.0
ND2 A:ASN53 4.8 15.3 1.0
OG1 A:TPO500 4.9 15.7 1.0
CA A:ASN59 4.9 15.2 1.0
O A:HOH2102 5.0 39.6 1.0

Calcium binding site 2 out of 10 in 2w08

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Calcium binding site 2 out of 10 in the The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 2 of The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca206

b:15.1
occ:1.00
O2P A:TPO500 2.4 16.1 1.0
OE1 A:GLU136 2.4 16.7 1.0
OE1 A:GLN148 2.4 15.5 1.0
O A:HOH2192 2.5 18.6 1.0
O A:HOH2184 2.5 15.5 1.0
OD2 A:ASP138 2.6 16.3 1.0
OD1 A:ASP138 2.6 16.9 1.0
CG A:ASP138 2.9 18.1 1.0
CD A:GLN148 3.3 14.7 1.0
CD A:GLU136 3.6 17.1 1.0
P A:TPO500 3.6 18.8 1.0
NE2 A:GLN148 3.6 21.5 1.0
O1P A:TPO500 3.9 15.9 1.0
CA A:CA205 3.9 15.1 1.0
CB A:ASP138 4.2 14.3 1.0
CB A:ASP145 4.3 16.1 1.0
O A:HOH2260 4.3 32.2 1.0
CG A:GLU136 4.3 12.3 1.0
CB A:GLU136 4.3 10.7 1.0
O3P A:TPO500 4.4 19.7 1.0
O A:GLU136 4.4 16.2 1.0
OE2 A:GLU136 4.5 11.5 1.0
OD2 A:ASP145 4.5 19.7 1.0
O A:GLN137 4.6 15.2 1.0
CG A:GLN148 4.7 13.2 1.0
O A:HOH2186 4.8 29.3 1.0
C A:GLU136 4.9 14.8 1.0
CA A:ASP138 4.9 19.3 1.0
N A:ASP138 4.9 16.2 1.0
C A:GLN137 4.9 18.5 1.0
O A:LYS143 4.9 19.7 1.0
OG1 A:TPO500 4.9 15.7 1.0
CG A:ASP145 5.0 20.5 1.0

Calcium binding site 3 out of 10 in 2w08

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Calcium binding site 3 out of 10 in the The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 3 of The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca205

b:8.8
occ:1.00
O2P B:TPO500 2.3 13.1 1.0
OE1 B:GLU136 2.4 10.2 1.0
OE1 B:GLN148 2.4 9.8 1.0
O B:HOH2200 2.4 11.0 1.0
O B:HOH2186 2.5 11.5 1.0
OD1 B:ASP138 2.6 8.8 1.0
OD2 B:ASP138 2.6 8.4 1.0
CG B:ASP138 2.8 10.1 1.0
CD B:GLN148 3.4 9.5 1.0
P B:TPO500 3.5 14.7 1.0
CD B:GLU136 3.6 8.2 1.0
NE2 B:GLN148 3.7 16.8 1.0
O1P B:TPO500 3.8 11.3 1.0
CA B:CA206 3.9 8.3 1.0
CB B:ASP138 4.3 9.7 1.0
O B:HOH2267 4.3 35.5 1.0
CB B:ASP145 4.3 8.9 1.0
O3P B:TPO500 4.3 18.2 1.0
CG B:GLU136 4.3 9.4 1.0
O B:GLU136 4.3 8.0 1.0
CB B:GLU136 4.3 7.7 1.0
OE2 B:GLU136 4.4 8.2 1.0
OD2 B:ASP145 4.6 12.6 1.0
O B:GLN137 4.6 7.7 1.0
CG B:GLN148 4.8 10.0 1.0
C B:GLN137 4.8 8.6 1.0
OG1 B:TPO500 4.8 14.8 1.0
C B:GLU136 4.8 8.0 1.0
O B:LYS143 4.8 10.8 1.0
N B:ASP138 4.9 6.7 1.0
CA B:ASP138 4.9 9.7 1.0
CG B:ASP145 5.0 11.7 1.0

Calcium binding site 4 out of 10 in 2w08

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Calcium binding site 4 out of 10 in the The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 4 of The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca206

b:8.3
occ:1.00
O1P B:TPO500 2.3 11.3 1.0
OD1 B:ASP138 2.4 8.8 1.0
OD1 B:ASN59 2.4 7.4 1.0
O B:GLN137 2.4 7.7 1.0
OE2 B:GLU136 2.5 8.2 1.0
OD1 B:ASP58 2.5 10.7 1.0
OE1 B:GLU136 2.6 10.2 1.0
OD2 B:ASP58 2.7 11.1 1.0
CD B:GLU136 2.9 8.2 1.0
CG B:ASP58 3.0 11.8 1.0
CG B:ASN59 3.4 7.3 1.0
C B:GLN137 3.5 8.6 1.0
CG B:ASP138 3.6 10.1 1.0
P B:TPO500 3.7 14.7 1.0
ND2 B:ASN59 3.7 10.4 1.0
CA B:ASP138 3.8 9.7 1.0
CA B:CA205 3.9 8.8 1.0
O2P B:TPO500 4.0 13.1 1.0
N B:ASP138 4.1 6.7 1.0
O B:HOH2082 4.2 9.0 1.0
CB B:ASP138 4.3 9.7 1.0
O B:HOH2268 4.3 35.1 1.0
O3P B:TPO500 4.4 18.2 1.0
N B:ASN59 4.4 7.4 1.0
CG B:GLU136 4.4 9.4 1.0
CB B:ASP58 4.5 10.8 1.0
OD2 B:ASP138 4.5 8.4 1.0
CB B:ASN59 4.7 9.7 1.0
CA B:GLN137 4.7 7.9 1.0
N B:GLN137 4.8 7.1 1.0
ND2 B:ASN53 4.8 9.2 1.0
OG1 B:TPO500 4.9 14.8 1.0
CA B:ASN59 4.9 8.2 1.0
OD1 B:ASN53 5.0 10.3 1.0

Calcium binding site 5 out of 10 in 2w08

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Calcium binding site 5 out of 10 in the The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 5 of The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Ca205

b:9.6
occ:1.00
O1P C:TPO500 2.3 12.7 1.0
OD1 C:ASN59 2.4 10.1 1.0
OD1 C:ASP138 2.4 12.9 1.0
O C:GLN137 2.4 10.1 1.0
OE2 C:GLU136 2.5 10.3 1.0
OD1 C:ASP58 2.5 12.4 1.0
OE1 C:GLU136 2.7 9.8 1.0
OD2 C:ASP58 2.8 13.9 1.0
CD C:GLU136 2.9 11.6 1.0
CG C:ASP58 3.0 12.5 1.0
CG C:ASN59 3.4 9.5 1.0
C C:GLN137 3.5 10.0 1.0
CG C:ASP138 3.6 10.0 1.0
P C:TPO500 3.7 15.8 1.0
ND2 C:ASN59 3.8 10.8 1.0
CA C:ASP138 3.9 11.6 1.0
CA C:CA206 3.9 12.1 1.0
O2P C:TPO500 4.0 13.4 1.0
N C:ASP138 4.1 11.2 1.0
O C:HOH2085 4.2 11.4 1.0
O C:HOH2117 4.3 24.6 1.0
CB C:ASP138 4.3 11.5 1.0
N C:ASN59 4.4 8.1 1.0
CG C:GLU136 4.4 8.2 1.0
O3P C:TPO500 4.5 16.6 1.0
CB C:ASP58 4.5 14.1 1.0
OD2 C:ASP138 4.6 12.2 1.0
CB C:ASN59 4.7 13.8 1.0
CA C:GLN137 4.8 10.0 1.0
N C:GLN137 4.8 7.3 1.0
ND2 C:ASN53 4.8 11.2 1.0
OG1 C:TPO500 4.8 16.3 1.0
CA C:ASN59 4.9 10.9 1.0
O C:HOH2190 4.9 9.7 1.0

Calcium binding site 6 out of 10 in 2w08

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Calcium binding site 6 out of 10 in the The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 6 of The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Ca206

b:12.1
occ:1.00
OE1 C:GLU136 2.4 9.8 1.0
OE1 C:GLN148 2.4 11.1 1.0
O2P C:TPO500 2.4 13.4 1.0
O C:HOH2190 2.4 9.7 1.0
O C:HOH2199 2.4 15.2 1.0
OD2 C:ASP138 2.6 12.2 1.0
OD1 C:ASP138 2.7 12.9 1.0
CG C:ASP138 2.9 10.0 1.0
CD C:GLN148 3.3 11.5 1.0
P C:TPO500 3.6 15.8 1.0
CD C:GLU136 3.6 11.6 1.0
NE2 C:GLN148 3.6 19.2 1.0
O1P C:TPO500 3.8 12.7 1.0
CA C:CA205 3.9 9.6 1.0
O C:HOH2272 4.0 32.8 1.0
CB C:ASP138 4.2 11.5 1.0
O C:HOH2271 4.2 26.4 1.0
CB C:ASP145 4.3 11.2 1.0
O C:GLU136 4.3 10.0 1.0
O3P C:TPO500 4.3 16.6 1.0
CG C:GLU136 4.3 8.2 1.0
CB C:GLU136 4.4 10.7 1.0
OE2 C:GLU136 4.5 10.3 1.0
O C:GLN137 4.6 10.1 1.0
OD2 C:ASP145 4.6 18.1 1.0
CG C:GLN148 4.7 11.0 1.0
C C:GLN137 4.8 10.0 1.0
N C:ASP138 4.8 11.2 1.0
C C:GLU136 4.8 8.9 1.0
O C:LYS143 4.8 14.0 1.0
O C:HOH2192 4.8 22.8 1.0
OG1 C:TPO500 4.9 16.3 1.0
CA C:ASP138 4.9 11.6 1.0
CG C:ASP145 5.0 17.9 1.0

Calcium binding site 7 out of 10 in 2w08

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Calcium binding site 7 out of 10 in the The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 7 of The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Ca205

b:11.5
occ:1.00
O2P D:TPO500 2.4 19.3 1.0
OE1 D:GLU136 2.4 11.1 1.0
OE1 D:GLN148 2.4 14.0 1.0
O D:HOH2176 2.4 13.1 1.0
O D:HOH2190 2.5 14.8 1.0
OD2 D:ASP138 2.6 12.5 1.0
OD1 D:ASP138 2.6 10.9 1.0
CG D:ASP138 2.9 13.7 1.0
CD D:GLN148 3.4 11.1 1.0
P D:TPO500 3.5 28.4 1.0
CD D:GLU136 3.6 11.3 1.0
NE2 D:GLN148 3.7 18.5 1.0
O1P D:TPO500 3.8 13.6 1.0
CA D:CA206 3.9 10.0 1.0
O D:HOH2267 4.0 27.6 1.0
O3P D:TPO500 4.2 33.7 1.0
CB D:ASP138 4.3 10.3 1.0
CB D:ASP145 4.3 12.2 1.0
CB D:GLU136 4.3 8.1 1.0
CG D:GLU136 4.3 10.1 1.0
O D:GLU136 4.4 10.8 1.0
OE2 D:GLU136 4.5 9.9 1.0
O D:GLN137 4.6 8.6 1.0
OD2 D:ASP145 4.6 17.1 1.0
O D:HOH2178 4.7 30.6 1.0
CG D:GLN148 4.8 9.7 1.0
C D:GLN137 4.8 8.8 1.0
C D:GLU136 4.8 8.9 1.0
N D:ASP138 4.8 9.1 1.0
O D:LYS143 4.9 13.0 1.0
OG1 D:TPO500 4.9 25.0 1.0
CA D:ASP138 4.9 12.2 1.0

Calcium binding site 8 out of 10 in 2w08

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Calcium binding site 8 out of 10 in the The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 8 of The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Ca206

b:10.0
occ:1.00
O1P D:TPO500 2.4 13.6 1.0
OD1 D:ASN59 2.4 10.2 1.0
OD1 D:ASP138 2.4 10.9 1.0
O D:GLN137 2.5 8.6 1.0
OE2 D:GLU136 2.5 9.9 1.0
OD1 D:ASP58 2.5 12.3 1.0
OE1 D:GLU136 2.7 11.1 1.0
OD2 D:ASP58 2.7 11.7 1.0
CD D:GLU136 2.9 11.3 1.0
CG D:ASP58 2.9 10.6 1.0
CG D:ASN59 3.3 10.2 1.0
C D:GLN137 3.5 8.8 1.0
CG D:ASP138 3.6 13.7 1.0
ND2 D:ASN59 3.7 12.2 1.0
P D:TPO500 3.7 28.4 1.0
CA D:ASP138 3.8 12.2 1.0
CA D:CA205 3.9 11.5 1.0
O2P D:TPO500 4.1 19.3 1.0
N D:ASP138 4.1 9.1 1.0
O D:HOH2076 4.1 9.0 1.0
CB D:ASP138 4.3 10.3 1.0
O3P D:TPO500 4.3 33.7 1.0
N D:ASN59 4.4 9.2 1.0
CG D:GLU136 4.4 10.1 1.0
CB D:ASP58 4.4 10.3 1.0
OD2 D:ASP138 4.6 12.5 1.0
CB D:ASN59 4.6 9.7 1.0
CA D:GLN137 4.7 8.8 1.0
N D:GLN137 4.8 8.5 1.0
ND2 D:ASN53 4.8 8.5 1.0
O D:HOH2094 4.9 29.3 1.0
CA D:ASN59 4.9 9.2 1.0
OG1 D:TPO500 4.9 25.0 1.0
OD1 D:ASN53 4.9 10.4 1.0

Calcium binding site 9 out of 10 in 2w08

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Calcium binding site 9 out of 10 in the The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 9 of The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Ca205

b:8.2
occ:1.00
O1P E:TPO500 2.3 11.2 1.0
OD1 E:ASP138 2.4 10.2 1.0
OD1 E:ASN59 2.4 8.5 1.0
OE2 E:GLU136 2.5 8.0 1.0
O E:GLN137 2.5 8.9 1.0
OD1 E:ASP58 2.6 10.5 1.0
OE1 E:GLU136 2.6 8.5 1.0
OD2 E:ASP58 2.7 12.2 1.0
CD E:GLU136 2.9 9.2 1.0
CG E:ASP58 3.0 9.4 1.0
CG E:ASN59 3.4 7.2 1.0
C E:GLN137 3.5 10.2 1.0
CG E:ASP138 3.6 9.5 1.0
P E:TPO500 3.7 15.6 1.0
ND2 E:ASN59 3.7 7.8 1.0
CA E:ASP138 3.8 10.2 1.0
CA E:CA206 3.9 8.9 1.0
O2P E:TPO500 4.1 12.3 1.0
N E:ASP138 4.1 7.7 1.0
O E:HOH2082 4.2 8.7 1.0
CB E:ASP138 4.3 11.7 1.0
O E:HOH2097 4.3 23.4 1.0
O3P E:TPO500 4.4 17.5 1.0
N E:ASN59 4.4 8.5 1.0
CG E:GLU136 4.4 6.7 1.0
CB E:ASP58 4.4 9.2 1.0
O E:HOH2098 4.5 33.8 1.0
OD2 E:ASP138 4.5 9.2 1.0
CB E:ASN59 4.7 9.5 1.0
CA E:GLN137 4.8 6.5 1.0
N E:GLN137 4.8 7.8 1.0
ND2 E:ASN53 4.8 8.1 1.0
OG1 E:TPO500 4.9 14.2 1.0
CA E:ASN59 4.9 7.5 1.0

Calcium binding site 10 out of 10 in 2w08

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Calcium binding site 10 out of 10 in the The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 10 of The Structure of Serum Amyloid P Component Bound to 0- Phospho-Threonine within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Ca206

b:8.9
occ:1.00
O2P E:TPO500 2.3 12.3 1.0
OE1 E:GLU136 2.4 8.5 1.0
O E:HOH2201 2.4 10.2 1.0
OE1 E:GLN148 2.4 10.2 1.0
O E:HOH2188 2.5 10.3 1.0
OD2 E:ASP138 2.6 9.2 1.0
OD1 E:ASP138 2.6 10.2 1.0
CG E:ASP138 2.9 9.5 1.0
CD E:GLN148 3.4 11.4 1.0
P E:TPO500 3.5 15.6 1.0
NE2 E:GLN148 3.6 14.1 1.0
CD E:GLU136 3.6 9.2 1.0
O1P E:TPO500 3.8 11.2 1.0
CA E:CA205 3.9 8.2 1.0
O E:HOH2281 4.0 31.1 1.0
O E:HOH2282 4.1 30.2 1.0
CB E:ASP138 4.3 11.7 1.0
CB E:ASP145 4.3 6.9 1.0
O3P E:TPO500 4.3 17.5 1.0
CG E:GLU136 4.3 6.7 1.0
CB E:GLU136 4.4 8.2 1.0
O E:GLU136 4.4 9.6 1.0
OE2 E:GLU136 4.5 8.0 1.0
OD2 E:ASP145 4.5 13.0 1.0
O E:GLN137 4.7 8.9 1.0
CG E:GLN148 4.8 9.1 1.0
OG1 E:TPO500 4.8 14.2 1.0
C E:GLN137 4.8 10.2 1.0
O E:LYS143 4.9 12.2 1.0
N E:ASP138 4.9 7.7 1.0
C E:GLU136 4.9 8.3 1.0
O E:HOH2189 4.9 20.2 1.0
CA E:ASP138 4.9 10.2 1.0
CG E:ASP145 5.0 12.0 1.0

Reference:

S.E.Kolstoe, B.H.Ridha, V.Bellotti, N.Wang, C.V.Robinson, S.J.Crutch, G.Keir, R.Kukkastenvehmas, J.R.Gallimore, W.L.Hutchinson, P.N.Hawkins, S.P.Wood, M.N.Rossor, M.B.Pepys. Molecular Dissection of Alzheimer'S Disease Neuropathology By Depletion of Serum Amyloid P Component. Proc.Natl.Acad.Sci.Usa V. 106 7619 2009.
ISSN: ISSN 0027-8424
PubMed: 19372378
DOI: 10.1073/PNAS.0902640106
Page generated: Fri Jul 12 18:18:39 2024

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