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Calcium in PDB 3kq4: Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin

Protein crystallography data

The structure of Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin, PDB code: 3kq4 was solved by C.B.F.Andersen, M.Madsen, S.K.Moestrup, G.R.Andersen, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 47.85 / 3.30
Space group C 2 2 21
Cell size a, b, c (Å), α, β, γ (°) 117.684, 204.179, 410.023, 90.00, 90.00, 90.00
R / Rfree (%) 21.1 / 24.3

Other elements in 3kq4:

The structure of Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin also contains other interesting chemical elements:

Cobalt (Co) 3 atoms

Calcium Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 12;

Binding sites:

The binding sites of Calcium atom in the Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin (pdb code 3kq4). This binding sites where shown within 5.0 Angstroms radius around Calcium atom.
In total 12 binding sites of Calcium where determined in the Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin, PDB code: 3kq4:
Jump to Calcium binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Calcium binding site 1 out of 12 in 3kq4

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Calcium binding site 1 out of 12 in the Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin


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Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 1 of Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca2014

b:0.7
occ:1.00
OE1 B:GLU980 2.3 0.9 1.0
O B:ASP1029 2.3 0.9 1.0
OD1 B:ASP988 2.3 0.6 1.0
OD1 B:ASP1027 2.3 0.9 1.0
O B:LEU1030 2.3 0.7 1.0
O B:ASP1027 3.1 0.8 1.0
C B:ASP1029 3.2 0.4 1.0
C B:LEU1030 3.3 0.8 1.0
CD B:GLU980 3.4 0.5 1.0
CG B:ASP988 3.5 0.9 1.0
CG B:ASP1027 3.5 0.5 1.0
N B:LEU1030 3.7 0.1 1.0
CA B:LEU1030 3.7 0.8 1.0
C B:ASP1027 3.8 0.8 1.0
CB B:LEU1030 3.8 0.4 1.0
OE2 B:GLU980 4.1 0.1 1.0
N B:ASP1027 4.1 0.9 1.0
N B:ASP1029 4.2 0.2 1.0
OD2 B:ASP988 4.2 0.7 1.0
OD2 B:ASP1027 4.3 0.6 1.0
CA B:ASP1029 4.3 0.6 1.0
CA B:ASP1027 4.3 0.7 1.0
CB B:ASP988 4.4 0.4 1.0
C B:SER1028 4.4 0.6 1.0
CG B:GLU980 4.5 0.8 1.0
CB B:ASP1027 4.5 0.7 1.0
N B:SER1028 4.5 0.6 1.0
N B:ALA1031 4.5 0.7 1.0
O B:SER1028 4.7 0.6 1.0
CB B:GLU980 4.7 0.4 1.0
CG B:LEU1030 4.7 0.2 1.0
OH B:TYR952 4.8 0.2 1.0

Calcium binding site 2 out of 12 in 3kq4

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Calcium binding site 2 out of 12 in the Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin


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Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 2 of Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca2015

b:54.5
occ:1.00
O B:ASP1149 2.3 0.3 1.0
OE1 B:GLU1096 2.3 78.8 1.0
OD2 B:ASP1146 2.3 66.4 1.0
O B:ILE1148 2.3 69.2 1.0
OD2 B:ASP1105 2.3 77.9 1.0
OD1 B:ASP1105 2.7 82.3 1.0
CG B:ASP1105 2.9 78.2 1.0
C B:ASP1149 3.3 0.7 1.0
C B:ILE1148 3.4 72.1 1.0
CG B:ASP1146 3.5 68.5 1.0
CD B:GLU1096 3.5 77.1 1.0
CB B:ASP1149 3.7 0.1 1.0
CA B:ASP1149 3.8 0.9 1.0
N B:ASP1149 3.9 0.4 1.0
O B:ASP1146 3.9 90.0 1.0
NZ A:LYS159 4.0 64.4 1.0
N B:ASP1146 4.0 80.0 1.0
OD1 B:ASN1070 4.1 74.1 1.0
OD1 B:ASP1146 4.2 64.6 1.0
CB B:GLU1096 4.3 73.2 1.0
CB B:ASP1105 4.3 66.9 1.0
OE2 B:GLU1096 4.3 78.3 1.0
C B:ASP1146 4.4 90.6 1.0
N B:THR1150 4.5 67.8 1.0
N B:ILE1148 4.5 81.5 1.0
CG B:GLU1096 4.5 74.4 1.0
CA B:ASP1146 4.5 84.7 1.0
CA B:ILE1148 4.5 80.8 1.0
OH B:TYR1068 4.6 57.1 1.0
CB B:ASP1146 4.6 76.9 1.0
CB B:SER1145 4.9 70.3 1.0
C B:SER1145 5.0 72.4 1.0
CA B:THR1150 5.0 70.2 1.0

Calcium binding site 3 out of 12 in 3kq4

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Calcium binding site 3 out of 12 in the Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 3 of Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca2016

b:0.7
occ:1.00
OE2 B:GLU1213 2.3 0.5 1.0
OD1 B:ASP1262 2.3 0.0 1.0
O B:GLY1264 2.3 0.5 1.0
OD1 B:ASP1221 2.3 0.7 1.0
O B:GLN1265 2.3 0.2 1.0
O B:ASP1262 2.3 0.9 1.0
OD2 B:ASP1221 2.7 0.0 1.0
CG B:ASP1221 2.8 0.3 1.0
C B:GLY1264 3.3 0.9 1.0
C B:ASP1262 3.3 0.5 1.0
C B:GLN1265 3.4 0.8 1.0
CG B:ASP1262 3.4 0.7 1.0
CD B:GLU1213 3.4 0.3 1.0
NE2 B:GLN1266 3.6 0.7 1.0
N B:ASP1262 3.7 0.8 1.0
O B:GLU1263 3.9 0.6 1.0
CA B:GLN1265 3.9 0.6 1.0
CA B:ASP1262 3.9 0.5 1.0
N B:GLN1265 4.0 0.1 1.0
CB B:GLN1265 4.0 0.1 1.0
C B:GLU1263 4.1 0.3 1.0
OE1 B:GLU1213 4.1 0.1 1.0
OD2 B:ASP1262 4.2 0.1 1.0
CB B:ASP1262 4.2 0.1 1.0
N B:GLY1264 4.3 0.3 1.0
CA B:GLY1264 4.3 0.2 1.0
CB B:ASP1221 4.3 0.9 1.0
CG B:GLU1213 4.4 0.5 1.0
CD B:GLN1266 4.4 0.6 1.0
N B:GLU1263 4.4 0.8 1.0
C B:THR1261 4.5 0.1 1.0
N B:GLN1266 4.5 0.8 1.0
CB B:THR1261 4.7 0.6 1.0
CA B:THR1261 4.8 0.6 1.0
CG B:GLN1265 4.8 0.1 1.0
CA B:GLU1263 4.8 0.2 1.0
OH B:TYR1185 5.0 0.8 1.0

Calcium binding site 4 out of 12 in 3kq4

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Calcium binding site 4 out of 12 in the Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 4 of Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca2017

b:82.6
occ:1.00
OE2 B:GLU1328 2.3 84.0 1.0
O B:VAL1375 2.3 91.4 1.0
OD2 B:ASP1336 2.3 87.7 1.0
OD1 B:ASP1373 2.3 95.2 1.0
CG B:ASP1336 3.2 87.4 1.0
CD B:GLU1328 3.3 84.8 1.0
OD1 B:ASP1336 3.5 82.3 1.0
C B:VAL1375 3.5 91.9 1.0
CG B:ASP1373 3.6 90.2 1.0
CG B:GLU1328 3.7 93.4 1.0
O B:ASP1373 3.8 94.6 1.0
OG1 B:THR1372 3.9 0.5 1.0
N B:VAL1375 4.0 91.9 1.0
CE1 B:TYR1300 4.1 65.1 1.0
N B:ASP1373 4.2 98.2 1.0
OH B:TYR1300 4.2 67.8 1.0
C B:ASP1373 4.2 92.5 1.0
OD2 B:ASP1373 4.3 85.0 1.0
OE2 B:GLU1379 4.4 70.2 1.0
CA B:VAL1375 4.4 91.1 1.0
N B:GLY1376 4.4 85.8 1.0
CA B:GLY1376 4.4 87.6 1.0
OE1 B:GLU1328 4.4 79.2 1.0
CB B:ASP1336 4.6 93.9 1.0
CB B:ASP1373 4.6 89.2 1.0
CA B:ASP1373 4.6 92.6 1.0
CZ B:TYR1300 4.6 70.2 1.0
CG2 B:VAL1375 4.8 90.1 1.0
NH1 A:ARG323 4.9 73.6 1.0
N B:GLY1374 4.9 69.6 1.0
CB B:GLU1328 5.0 93.5 1.0

Calcium binding site 5 out of 12 in 3kq4

Go back to Calcium Binding Sites List in 3kq4
Calcium binding site 5 out of 12 in the Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 5 of Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Ca2014

b:0.1
occ:1.00
O D:ASP1029 2.3 0.0 1.0
OE1 D:GLU980 2.3 0.3 1.0
OD1 D:ASP988 2.3 0.8 1.0
OD1 D:ASP1027 2.3 0.2 1.0
O D:LEU1030 2.3 0.5 1.0
O D:ASP1027 3.1 0.9 1.0
C D:ASP1029 3.2 0.5 1.0
C D:LEU1030 3.3 0.1 1.0
CD D:GLU980 3.4 0.9 1.0
CG D:ASP988 3.5 1.0 1.0
CG D:ASP1027 3.5 0.2 1.0
N D:LEU1030 3.7 0.6 1.0
CA D:LEU1030 3.7 0.3 1.0
C D:ASP1027 3.8 0.5 1.0
CB D:LEU1030 3.8 0.8 1.0
OE2 D:GLU980 4.1 0.6 1.0
N D:ASP1027 4.1 0.3 1.0
N D:ASP1029 4.2 0.0 1.0
OD2 D:ASP988 4.2 0.1 1.0
OD2 D:ASP1027 4.3 0.1 1.0
CA D:ASP1029 4.3 0.9 1.0
CA D:ASP1027 4.3 1.0 1.0
CB D:ASP988 4.4 0.6 1.0
C D:SER1028 4.4 0.1 1.0
CG D:GLU980 4.5 0.2 1.0
CB D:ASP1027 4.5 0.5 1.0
N D:SER1028 4.5 0.6 1.0
N D:ALA1031 4.5 0.6 1.0
O D:SER1028 4.7 0.6 1.0
CB D:GLU980 4.7 0.5 1.0
CG D:LEU1030 4.7 0.1 1.0
OH D:TYR952 4.8 1.0 1.0

Calcium binding site 6 out of 12 in 3kq4

Go back to Calcium Binding Sites List in 3kq4
Calcium binding site 6 out of 12 in the Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 6 of Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Ca2015

b:60.4
occ:1.00
O D:ASP1149 2.3 0.9 1.0
OE1 D:GLU1096 2.3 75.0 1.0
OD2 D:ASP1146 2.3 57.5 1.0
O D:ILE1148 2.3 79.5 1.0
OD2 D:ASP1105 2.3 74.9 1.0
OD1 D:ASP1105 2.7 78.3 1.0
CG D:ASP1105 2.9 76.6 1.0
C D:ASP1149 3.3 0.2 1.0
C D:ILE1148 3.4 79.7 1.0
CG D:ASP1146 3.5 58.7 1.0
CD D:GLU1096 3.5 73.7 1.0
CB D:ASP1149 3.7 0.3 1.0
CA D:ASP1149 3.8 0.9 1.0
N D:ASP1149 3.9 0.1 1.0
O D:ASP1146 3.9 75.5 1.0
NZ C:LYS159 4.0 77.6 1.0
N D:ASP1146 4.0 73.1 1.0
OD1 D:ASN1070 4.1 80.2 1.0
OD1 D:ASP1146 4.2 54.9 1.0
CB D:GLU1096 4.3 76.4 1.0
CB D:ASP1105 4.3 70.0 1.0
OE2 D:GLU1096 4.3 72.6 1.0
C D:ASP1146 4.4 75.5 1.0
N D:THR1150 4.5 78.3 1.0
N D:ILE1148 4.5 85.3 1.0
CG D:GLU1096 4.5 74.4 1.0
CA D:ASP1146 4.5 73.4 1.0
CA D:ILE1148 4.5 84.4 1.0
OH D:TYR1068 4.6 58.9 1.0
CB D:ASP1146 4.6 65.7 1.0
CB D:SER1145 4.9 76.6 1.0
C D:SER1145 5.0 74.0 1.0
CA D:THR1150 5.0 83.5 1.0

Calcium binding site 7 out of 12 in 3kq4

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Calcium binding site 7 out of 12 in the Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 7 of Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Ca2016

b:0.0
occ:1.00
OE2 D:GLU1213 2.3 0.8 1.0
OD1 D:ASP1262 2.3 0.9 1.0
O D:GLY1264 2.3 0.7 1.0
OD1 D:ASP1221 2.3 0.5 1.0
O D:GLN1265 2.3 0.2 1.0
O D:ASP1262 2.3 0.9 1.0
OD2 D:ASP1221 2.7 0.1 1.0
CG D:ASP1221 2.8 0.2 1.0
C D:GLY1264 3.3 0.2 1.0
C D:ASP1262 3.3 0.5 1.0
C D:GLN1265 3.4 0.8 1.0
CG D:ASP1262 3.4 0.9 1.0
CD D:GLU1213 3.4 0.9 1.0
NE2 D:GLN1266 3.6 0.3 1.0
N D:ASP1262 3.7 0.0 1.0
O D:GLU1263 3.9 0.3 1.0
CA D:GLN1265 3.9 0.7 1.0
CA D:ASP1262 3.9 0.6 1.0
N D:GLN1265 4.0 0.1 1.0
CB D:GLN1265 4.0 0.1 1.0
C D:GLU1263 4.1 0.1 1.0
OE1 D:GLU1213 4.1 0.7 1.0
OD2 D:ASP1262 4.2 0.5 1.0
CB D:ASP1262 4.2 0.9 1.0
N D:GLY1264 4.3 0.2 1.0
CA D:GLY1264 4.3 0.1 1.0
CB D:ASP1221 4.3 0.8 1.0
CG D:GLU1213 4.4 0.4 1.0
CD D:GLN1266 4.4 0.8 1.0
N D:GLU1263 4.4 0.2 1.0
C D:THR1261 4.5 0.5 1.0
N D:GLN1266 4.5 0.2 1.0
CB D:THR1261 4.7 0.0 1.0
CA D:THR1261 4.8 0.6 1.0
CG D:GLN1265 4.8 0.5 1.0
CA D:GLU1263 4.8 0.7 1.0
OH D:TYR1185 5.0 0.6 1.0

Calcium binding site 8 out of 12 in 3kq4

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Calcium binding site 8 out of 12 in the Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 8 of Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Ca2017

b:79.7
occ:1.00
OE2 D:GLU1328 2.3 83.0 1.0
O D:VAL1375 2.3 93.9 1.0
OD2 D:ASP1336 2.3 91.6 1.0
OD1 D:ASP1373 2.3 91.9 1.0
CG D:ASP1336 3.2 91.9 1.0
CD D:GLU1328 3.3 82.4 1.0
OD1 D:ASP1336 3.5 88.1 1.0
C D:VAL1375 3.5 92.0 1.0
CG D:ASP1373 3.6 86.6 1.0
CG D:GLU1328 3.7 91.6 1.0
O D:ASP1373 3.8 95.4 1.0
OG1 D:THR1372 3.9 0.5 1.0
N D:VAL1375 4.0 93.8 1.0
CE1 D:TYR1300 4.1 63.8 1.0
OH D:TYR1300 4.2 62.0 1.0
N D:ASP1373 4.2 99.9 1.0
C D:ASP1373 4.2 92.4 1.0
OD2 D:ASP1373 4.3 78.9 1.0
OE2 D:GLU1379 4.4 72.3 1.0
CA D:VAL1375 4.4 90.0 1.0
N D:GLY1376 4.4 93.7 1.0
CA D:GLY1376 4.4 96.1 1.0
OE1 D:GLU1328 4.4 74.2 1.0
CB D:ASP1336 4.5 97.4 1.0
CB D:ASP1373 4.6 87.5 1.0
CA D:ASP1373 4.6 93.1 1.0
CZ D:TYR1300 4.6 66.8 1.0
CG2 D:VAL1375 4.8 85.7 1.0
NH1 C:ARG323 4.9 74.6 1.0
N D:GLY1374 4.9 76.9 1.0
CB D:GLU1328 5.0 90.1 1.0

Calcium binding site 9 out of 12 in 3kq4

Go back to Calcium Binding Sites List in 3kq4
Calcium binding site 9 out of 12 in the Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 9 of Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Ca2014

b:0.6
occ:1.00
O F:ASP1029 2.3 0.3 1.0
OE1 F:GLU980 2.3 0.9 1.0
OD1 F:ASP988 2.3 0.3 1.0
OD1 F:ASP1027 2.3 0.6 1.0
O F:LEU1030 2.3 0.9 1.0
O F:ASP1027 3.1 0.2 1.0
C F:ASP1029 3.2 0.6 1.0
C F:LEU1030 3.3 0.5 1.0
CD F:GLU980 3.4 0.2 1.0
CG F:ASP988 3.5 0.6 1.0
CG F:ASP1027 3.5 0.6 1.0
N F:LEU1030 3.7 0.5 1.0
CA F:LEU1030 3.7 0.2 1.0
C F:ASP1027 3.8 0.9 1.0
CB F:LEU1030 3.8 0.4 1.0
OE2 F:GLU980 4.1 0.8 1.0
N F:ASP1027 4.1 0.4 1.0
N F:ASP1029 4.2 0.1 1.0
OD2 F:ASP988 4.2 0.5 1.0
CA F:ASP1029 4.3 0.6 1.0
OD2 F:ASP1027 4.3 0.0 1.0
CA F:ASP1027 4.3 0.1 1.0
CB F:ASP988 4.4 0.5 1.0
C F:SER1028 4.4 0.4 1.0
CG F:GLU980 4.5 0.5 1.0
CB F:ASP1027 4.5 0.4 1.0
N F:SER1028 4.5 0.0 1.0
N F:ALA1031 4.5 1.0 1.0
O F:SER1028 4.7 0.6 1.0
CB F:GLU980 4.7 0.9 1.0
CG F:LEU1030 4.7 0.5 1.0
OH F:TYR952 4.8 0.9 1.0

Calcium binding site 10 out of 12 in 3kq4

Go back to Calcium Binding Sites List in 3kq4
Calcium binding site 10 out of 12 in the Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 10 of Structure of Intrinsic Factor-Cobalamin Bound to Its Receptor Cubilin within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Ca2015

b:58.4
occ:1.00
O F:ASP1149 2.3 0.5 1.0
OE1 F:GLU1096 2.3 77.3 1.0
OD2 F:ASP1146 2.3 61.2 1.0
O F:ILE1148 2.3 74.3 1.0
OD2 F:ASP1105 2.3 81.9 1.0
OD1 F:ASP1105 2.7 89.5 1.0
CG F:ASP1105 2.9 84.4 1.0
C F:ASP1149 3.3 0.2 1.0
C F:ILE1148 3.4 75.4 1.0
CG F:ASP1146 3.5 64.0 1.0
CD F:GLU1096 3.5 73.4 1.0
CB F:ASP1149 3.7 1.0 1.0
CA F:ASP1149 3.8 0.7 1.0
N F:ASP1149 3.9 0.6 1.0
O F:ASP1146 3.9 87.0 1.0
NZ E:LYS159 4.0 68.9 1.0
N F:ASP1146 4.0 82.3 1.0
OD1 F:ASN1070 4.1 69.0 1.0
OD1 F:ASP1146 4.2 58.4 1.0
CB F:GLU1096 4.3 71.4 1.0
CB F:ASP1105 4.3 74.7 1.0
OE2 F:GLU1096 4.3 72.9 1.0
C F:ASP1146 4.4 88.1 1.0
N F:THR1150 4.5 78.4 1.0
N F:ILE1148 4.5 86.9 1.0
CG F:GLU1096 4.5 70.0 1.0
CA F:ASP1146 4.5 85.1 1.0
CA F:ILE1148 4.5 83.5 1.0
OH F:TYR1068 4.6 54.2 1.0
CB F:ASP1146 4.6 75.3 1.0
CB F:SER1145 4.9 70.1 1.0
C F:SER1145 5.0 71.7 1.0
CA F:THR1150 5.0 83.2 1.0

Reference:

C.B.Andersen, M.Madsen, T.Storm, S.K.Moestrup, G.R.Andersen. Structural Basis For Receptor Recognition of Vitamin-B(12)-Intrinsic Factor Complexes. Nature V. 464 445 2010.
ISSN: ISSN 0028-0836
PubMed: 20237569
DOI: 10.1038/NATURE08874
Page generated: Sat Dec 12 04:17:56 2020

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