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Calcium in PDB 6oad: 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.

Enzymatic activity of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.

All present enzymatic activity of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.:
3.4.11.23;

Protein crystallography data

The structure of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655., PDB code: 6oad was solved by G.Minasov, L.Shuvalova, Z.Wawrzak, O.Kiryukhina, S.Grimshaw, K.Kwon, K.J.F.Satchell, Center For Structural Genomics Of Infectious Diseases(Csgid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 29.88 / 2.05
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 150.667, 114.761, 161.171, 90.00, 92.02, 90.00
R / Rfree (%) 17.2 / 21.5

Other elements in 6oad:

The structure of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. also contains other interesting chemical elements:

Chlorine (Cl) 11 atoms
Zinc (Zn) 24 atoms

Calcium Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 13;

Binding sites:

The binding sites of Calcium atom in the 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. (pdb code 6oad). This binding sites where shown within 5.0 Angstroms radius around Calcium atom.
In total 13 binding sites of Calcium where determined in the 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655., PDB code: 6oad:
Jump to Calcium binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Calcium binding site 1 out of 13 in 6oad

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Calcium binding site 1 out of 13 in the 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 1 of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca503

b:34.0
occ:1.00
 O A:ALA116 2.6 25.4 1.0
O A:LYS216 2.6 31.7 1.0
O A:HOH679 2.7 25.0 1.0
O A:ILE114 2.9 26.9 1.0
O A:THR113 3.0 28.7 1.0
SD A:MET219 3.3 26.8 1.0
C A:ILE114 3.5 26.4 1.0
C A:LYS216 3.7 31.4 1.0
C A:ALA116 3.7 26.4 1.0
CD2 A:LEU121 3.7 28.9 1.0
CA A:ILE114 3.8 27.0 1.0
N A:ALA116 4.0 26.2 1.0
CG A:MET219 4.0 26.6 1.0
C A:THR113 4.1 28.9 1.0
CB A:LYS216 4.2 33.0 1.0
CA A:ALA116 4.2 26.4 1.0
CE A:MET219 4.3 27.5 1.0
CB A:ALA116 4.4 27.0 1.0
CA A:LYS216 4.4 32.3 1.0
CB A:LEU121 4.5 29.0 1.0
CG A:LYS216 4.5 33.5 1.0
N A:ASN115 4.5 26.1 1.0
N A:ILE114 4.5 27.9 1.0
C A:ASN115 4.5 26.0 1.0
N A:SER217 4.6 30.3 1.0
CG A:LEU121 4.7 29.1 1.0
CA A:SER217 4.8 30.0 1.0
C A:PRO117 4.8 27.4 1.0
N A:PRO117 4.8 26.8 1.0
O A:PRO117 4.8 27.3 1.0
O A:THR198 4.9 27.4 1.0

Calcium binding site 2 out of 13 in 6oad

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Calcium binding site 2 out of 13 in the 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 2 of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca503

b:35.4
occ:1.00
 O B:ALA116 2.6 28.5 1.0
O B:LYS216 2.6 31.8 1.0
O B:HOH752 2.8 27.2 1.0
O B:ILE114 2.8 27.8 1.0
O B:THR113 3.1 28.5 1.0
SD B:MET219 3.5 29.7 1.0
C B:ILE114 3.5 27.8 1.0
C B:LYS216 3.6 31.9 1.0
C B:ALA116 3.7 28.5 1.0
CD2 B:LEU121 3.8 28.3 1.0
N B:ALA116 3.9 28.3 1.0
CA B:ILE114 3.9 27.9 1.0
CB B:LYS216 4.0 32.0 1.0
CG B:MET219 4.0 29.6 1.0
CA B:ALA116 4.2 28.6 1.0
C B:THR113 4.2 30.4 1.0
CA B:LYS216 4.3 31.6 1.0
CB B:ALA116 4.3 28.9 1.0
CG B:LYS216 4.4 32.3 1.0
C B:ASN115 4.5 28.3 1.0
N B:ASN115 4.5 27.9 1.0
CE B:MET219 4.5 30.6 1.0
N B:SER217 4.5 31.4 1.0
CB B:LEU121 4.5 28.8 1.0
N B:ILE114 4.6 29.6 1.0
CA B:SER217 4.8 31.8 1.0
C B:PRO117 4.8 28.5 1.0
N B:PRO117 4.8 28.6 1.0
CG B:LEU121 4.8 28.6 1.0
O B:PRO117 4.8 28.2 1.0
O B:THR198 4.9 26.5 1.0
CD B:LYS216 5.0 33.0 1.0
CA B:ASN115 5.0 28.7 1.0

Calcium binding site 3 out of 13 in 6oad

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Calcium binding site 3 out of 13 in the 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 3 of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Ca503

b:40.7
occ:1.00
 O C:LYS216 2.6 34.7 1.0
O C:ALA116 2.6 31.0 1.0
O C:HOH683 2.9 33.1 1.0
O C:ILE114 2.9 30.5 1.0
O C:THR113 3.2 31.4 1.0
SD C:MET219 3.4 34.3 1.0
C C:ILE114 3.6 30.8 1.0
C C:LYS216 3.6 34.1 1.0
C C:ALA116 3.7 31.3 1.0
CD2 C:LEU121 3.9 34.4 1.0
CA C:ILE114 3.9 31.0 1.0
N C:ALA116 4.0 31.4 1.0
CG C:MET219 4.0 33.3 1.0
CB C:LYS216 4.2 36.1 1.0
CA C:ALA116 4.2 31.9 1.0
C C:THR113 4.2 31.8 1.0
CA C:LYS216 4.4 35.0 1.0
CE C:MET219 4.4 34.4 1.0
CB C:ALA116 4.4 32.4 1.0
C C:ASN115 4.5 31.1 1.0
CG C:LYS216 4.5 36.8 1.0
N C:ASN115 4.5 31.4 1.0
N C:SER217 4.5 33.1 1.0
CB C:LEU121 4.6 34.5 1.0
N C:ILE114 4.6 32.0 1.0
CA C:SER217 4.7 33.2 1.0
C C:PRO117 4.8 31.3 1.0
O C:PRO117 4.8 31.3 1.0
N C:PRO117 4.8 31.8 1.0
CG C:LEU121 4.9 34.4 1.0
O C:THR198 4.9 31.4 1.0

Calcium binding site 4 out of 13 in 6oad

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Calcium binding site 4 out of 13 in the 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 4 of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Ca503

b:37.0
occ:1.00
 O D:LYS216 2.6 30.7 1.0
O D:ALA116 2.6 30.9 1.0
O D:ILE114 2.8 30.3 1.0
O D:HOH740 2.9 30.5 1.0
O D:THR113 3.2 31.2 1.0
SD D:MET219 3.4 28.3 1.0
C D:ILE114 3.5 30.6 1.0
C D:ALA116 3.6 31.3 1.0
C D:LYS216 3.7 30.7 1.0
CD2 D:LEU121 3.7 31.3 1.0
N D:ALA116 3.8 31.3 1.0
CA D:ILE114 3.9 30.7 1.0
CG D:MET219 4.1 27.9 1.0
CA D:ALA116 4.1 31.6 1.0
CB D:LYS216 4.1 31.2 1.0
C D:THR113 4.2 31.4 1.0
CB D:ALA116 4.2 31.8 1.0
CA D:LYS216 4.4 30.8 1.0
N D:ASN115 4.4 30.9 1.0
CE D:MET219 4.4 28.9 1.0
C D:ASN115 4.4 31.1 1.0
CG D:LYS216 4.5 31.7 1.0
CB D:LEU121 4.5 31.6 1.0
N D:ILE114 4.5 31.1 1.0
N D:SER217 4.6 30.5 1.0
CG D:LEU121 4.7 31.6 1.0
O D:PRO117 4.8 31.6 1.0
C D:PRO117 4.8 31.4 1.0
N D:PRO117 4.8 31.6 1.0
CA D:SER217 4.8 30.6 1.0
CD D:LYS216 4.9 31.9 1.0
CA D:ASN115 4.9 30.9 1.0

Calcium binding site 5 out of 13 in 6oad

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Calcium binding site 5 out of 13 in the 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 5 of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Ca503

b:41.5
occ:1.00
 O E:ALA116 2.6 31.8 1.0
O E:LYS216 2.7 35.5 1.0
O E:HOH703 2.8 30.8 1.0
O E:ILE114 2.8 29.5 1.0
O E:THR113 3.0 32.4 1.0
SD E:MET219 3.4 32.4 1.0
C E:ILE114 3.5 31.5 1.0
CD2 E:LEU121 3.6 35.0 1.0
C E:ALA116 3.7 32.2 1.0
C E:LYS216 3.7 36.0 1.0
CA E:ILE114 3.8 32.1 1.0
N E:ALA116 4.0 33.0 1.0
CG E:MET219 4.1 31.5 1.0
C E:THR113 4.1 33.7 1.0
CA E:ALA116 4.2 33.6 1.0
CB E:LYS216 4.2 36.9 1.0
CE E:MET219 4.3 32.7 1.0
CB E:ALA116 4.3 34.4 1.0
CG E:LYS216 4.4 37.8 1.0
CA E:LYS216 4.4 36.2 1.0
N E:ILE114 4.5 32.8 1.0
C E:ASN115 4.5 32.2 1.0
N E:ASN115 4.5 31.6 1.0
CB E:LEU121 4.5 35.9 1.0
N E:SER217 4.6 35.2 1.0
CG E:LEU121 4.7 35.4 1.0
CA E:SER217 4.8 35.6 1.0
N E:PRO117 4.8 32.5 1.0
C E:PRO117 4.8 32.2 1.0
O E:PRO117 4.9 32.8 1.0
CD E:LYS216 5.0 38.8 1.0
O E:ASN115 5.0 31.9 1.0
O E:THR198 5.0 31.8 1.0
CA E:ASN115 5.0 31.9 1.0

Calcium binding site 6 out of 13 in 6oad

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Calcium binding site 6 out of 13 in the 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 6 of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Ca503

b:36.6
occ:1.00
 O F:LYS216 2.6 31.7 1.0
O F:ALA116 2.6 28.9 1.0
O F:HOH686 2.8 25.1 1.0
O F:ILE114 2.8 27.5 1.0
O F:THR113 3.1 31.1 1.0
SD F:MET219 3.2 29.9 1.0
C F:ILE114 3.5 28.5 1.0
C F:LYS216 3.6 32.3 1.0
C F:ALA116 3.7 29.6 1.0
CA F:ILE114 3.9 29.0 1.0
CD2 F:LEU121 3.9 29.8 1.0
CG F:MET219 4.0 29.2 1.0
N F:ALA116 4.1 29.3 1.0
CB F:LYS216 4.1 33.6 1.0
CE F:MET219 4.2 30.2 1.0
C F:THR113 4.2 30.9 1.0
CA F:ALA116 4.3 29.6 1.0
CA F:LYS216 4.4 33.5 1.0
CB F:ALA116 4.4 30.3 1.0
CG F:LYS216 4.5 34.0 1.0
N F:ASN115 4.5 28.8 1.0
N F:ILE114 4.5 30.2 1.0
N F:SER217 4.5 31.4 1.0
C F:ASN115 4.6 29.4 1.0
CB F:LEU121 4.6 29.8 1.0
CA F:SER217 4.7 31.2 1.0
C F:PRO117 4.8 29.6 1.0
O F:PRO117 4.8 29.3 1.0
N F:PRO117 4.9 30.2 1.0
O F:THR198 4.9 29.2 1.0
CG F:LEU121 4.9 30.3 1.0
CD F:LYS216 5.0 34.7 1.0

Calcium binding site 7 out of 13 in 6oad

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Calcium binding site 7 out of 13 in the 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 7 of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. within 5.0Å range:
probe atom residue distance (Å) B Occ
G:Ca503

b:35.8
occ:1.00
 O G:ALA116 2.5 28.1 1.0
O G:LYS216 2.6 35.8 1.0
O G:HOH732 2.8 28.1 1.0
O G:ILE114 2.8 28.4 1.0
O G:THR113 3.2 31.4 1.0
SD G:MET219 3.4 32.6 1.0
C G:ILE114 3.5 29.0 1.0
CD2 G:LEU121 3.6 29.8 1.0
C G:ALA116 3.6 28.8 1.0
C G:LYS216 3.6 35.2 1.0
CA G:ILE114 3.9 29.3 1.0
N G:ALA116 4.0 29.0 1.0
CG G:MET219 4.1 31.8 1.0
CB G:LYS216 4.1 35.2 1.0
CA G:ALA116 4.2 29.4 1.0
C G:THR113 4.2 30.8 1.0
CB G:ALA116 4.3 29.6 1.0
CA G:LYS216 4.3 34.8 1.0
CE G:MET219 4.4 33.0 1.0
C G:ASN115 4.5 29.3 1.0
CG G:LYS216 4.5 35.6 1.0
CB G:LEU121 4.5 30.5 1.0
N G:ASN115 4.5 29.0 1.0
N G:ILE114 4.5 30.5 1.0
N G:SER217 4.6 34.2 1.0
CG G:LEU121 4.7 30.3 1.0
N G:PRO117 4.7 29.0 1.0
C G:PRO117 4.8 28.6 1.0
CA G:SER217 4.8 34.0 1.0
O G:PRO117 4.9 27.9 1.0
O G:THR198 4.9 29.9 1.0
O G:ASN115 5.0 30.0 1.0
CD G:LYS216 5.0 36.2 1.0

Calcium binding site 8 out of 13 in 6oad

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Calcium binding site 8 out of 13 in the 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 8 of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. within 5.0Å range:
probe atom residue distance (Å) B Occ
H:Ca503

b:39.6
occ:1.00
 O H:ALA116 2.6 29.4 1.0
O H:LYS216 2.7 31.9 1.0
O H:ILE114 2.8 27.5 1.0
O H:HOH745 2.9 33.9 1.0
O H:THR113 3.3 30.8 1.0
SD H:MET219 3.4 30.5 1.0
C H:ILE114 3.5 28.4 1.0
C H:LYS216 3.6 31.7 1.0
C H:ALA116 3.7 30.0 1.0
CD2 H:LEU121 3.8 33.8 1.0
CA H:ILE114 4.0 29.0 1.0
CB H:LYS216 4.0 33.3 1.0
N H:ALA116 4.0 29.0 1.0
CG H:MET219 4.1 29.5 1.0
CA H:ALA116 4.3 29.4 1.0
CA H:LYS216 4.3 32.4 1.0
CG H:LYS216 4.3 33.5 1.0
C H:THR113 4.3 30.3 1.0
CE H:MET219 4.4 31.4 1.0
CB H:ALA116 4.4 29.9 1.0
C H:ASN115 4.4 28.7 1.0
N H:ASN115 4.5 28.3 1.0
N H:SER217 4.5 31.2 1.0
CB H:LEU121 4.6 33.9 1.0
N H:ILE114 4.7 29.6 1.0
O H:PRO117 4.7 30.4 1.0
C H:PRO117 4.7 31.0 1.0
CA H:SER217 4.8 31.1 1.0
CD H:LYS216 4.8 34.5 1.0
CG H:LEU121 4.8 33.5 1.0
N H:PRO117 4.8 30.9 1.0
O H:THR198 4.9 29.9 1.0
CA H:ASN115 4.9 28.9 1.0
O H:ASN115 5.0 28.0 1.0

Calcium binding site 9 out of 13 in 6oad

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Calcium binding site 9 out of 13 in the 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 9 of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. within 5.0Å range:
probe atom residue distance (Å) B Occ
I:Ca503

b:31.2
occ:1.00
 O I:ALA116 2.5 26.3 1.0
O I:HOH801 2.8 27.5 1.0
O I:LYS216 2.8 32.6 1.0
O I:ILE114 2.8 25.2 1.0
O I:THR113 3.0 25.9 1.0
SD I:MET219 3.4 26.8 1.0
C I:ILE114 3.5 25.4 1.0
C I:ALA116 3.6 26.4 1.0
CD2 I:LEU121 3.7 29.0 1.0
C I:LYS216 3.8 33.0 1.0
CA I:ILE114 3.8 25.8 1.0
N I:ALA116 3.9 25.8 1.0
C I:THR113 4.0 26.7 1.0
CG I:MET219 4.1 26.6 1.0
CA I:ALA116 4.2 26.3 1.0
CB I:LYS216 4.2 33.7 1.0
CE I:MET219 4.3 27.2 1.0
CB I:ALA116 4.3 26.5 1.0
C I:ASN115 4.4 25.8 1.0
N I:ILE114 4.5 26.2 1.0
CA I:LYS216 4.5 33.4 1.0
N I:ASN115 4.5 25.1 1.0
CB I:LEU121 4.5 29.3 1.0
CG I:LYS216 4.5 33.8 1.0
N I:SER217 4.7 32.0 1.0
CG I:LEU121 4.7 29.2 1.0
N I:PRO117 4.8 26.9 1.0
C I:PRO117 4.8 27.5 1.0
O I:PRO117 4.9 27.6 1.0
CA I:SER217 4.9 31.4 1.0
CA I:ASN115 5.0 25.4 1.0
O I:ASN115 5.0 26.3 1.0

Calcium binding site 10 out of 13 in 6oad

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Calcium binding site 10 out of 13 in the 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655.


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 10 of 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. within 5.0Å range:
probe atom residue distance (Å) B Occ
I:Ca504

b:45.2
occ:1.00
 O I:HOH838 2.3 47.4 1.0
OD1 I:ASP151 2.4 34.7 1.0
O D:HOH725 2.4 34.6 1.0
O D:HOH797 2.5 36.6 1.0
O D:HOH672 2.5 40.9 1.0
OE1 I:GLU154 2.5 33.3 1.0
OE2 I:GLU154 2.8 34.2 1.0
CD I:GLU154 3.0 33.5 1.0
CG I:ASP151 3.6 34.4 1.0
O D:HOH608 4.0 42.0 1.0
O I:HOH622 4.1 31.7 1.0
O I:HOH635 4.1 52.2 1.0
OD2 I:ASP151 4.3 35.3 1.0
NZ D:LYS148 4.4 35.5 1.0
CG I:GLU154 4.5 32.9 1.0
O2 D:BCT506 4.5 42.6 1.0
CA I:ASP151 4.6 32.7 1.0
CB I:ASP151 4.6 33.3 1.0
O D:HOH867 4.7 29.3 0.5
O1 D:BCT506 4.8 58.7 1.0
N I:ASP151 4.8 32.1 1.0
NE2 D:GLN125 4.8 33.9 1.0
OG D:SER124 4.9 33.2 1.0
CB D:SER124 4.9 33.3 1.0
C D:BCT506 4.9 50.5 1.0

Reference:

G.Minasov, L.Shuvalova, Z.Wawrzak, O.Kiryukhina, S.Grimshaw, K.Kwon, K.J.F.Satchell, Center For Structural Genomics Of Infectious Diseases(Csgid). 2.05 Angstrom Resolution Crystal Structure of Aminopeptidase B From Escherichia Coli Str. K-12 Substr. MG1655. To Be Published.
Page generated: Tue Jul 16 12:23:03 2024

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