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Calcium in PDB 8a7d: Partial Dimer Complex of Papp-A and Its Inhibitor STC2

Enzymatic activity of Partial Dimer Complex of Papp-A and Its Inhibitor STC2

All present enzymatic activity of Partial Dimer Complex of Papp-A and Its Inhibitor STC2:
3.4.24.79;

Other elements in 8a7d:

The structure of Partial Dimer Complex of Papp-A and Its Inhibitor STC2 also contains other interesting chemical elements:

Zinc (Zn) 1 atom

Calcium Binding Sites:

The binding sites of Calcium atom in the Partial Dimer Complex of Papp-A and Its Inhibitor STC2 (pdb code 8a7d). This binding sites where shown within 5.0 Angstroms radius around Calcium atom.
In total 8 binding sites of Calcium where determined in the Partial Dimer Complex of Papp-A and Its Inhibitor STC2, PDB code: 8a7d:
Jump to Calcium binding site number: 1; 2; 3; 4; 5; 6; 7; 8;

Calcium binding site 1 out of 8 in 8a7d

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Calcium binding site 1 out of 8 in the Partial Dimer Complex of Papp-A and Its Inhibitor STC2


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 1 of Partial Dimer Complex of Papp-A and Its Inhibitor STC2 within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Ca1709

b:169.0
occ:1.00
O C:LYS418 2.2 115.2 1.0
OD2 C:ASP436 2.2 135.4 1.0
OD1 C:ASP421 2.3 142.4 1.0
OD2 C:ASP439 2.3 141.1 1.0
O C:ASN423 2.4 146.2 1.0
OD2 C:ASP425 2.4 135.8 1.0
OD1 C:ASP436 2.6 136.2 1.0
CG C:ASP436 2.7 135.1 1.0
CG C:ASP421 3.1 140.2 1.0
CG C:ASP439 3.4 140.1 1.0
OD2 C:ASP421 3.4 139.3 1.0
CG C:ASP425 3.4 134.6 1.0
C C:LYS418 3.5 116.1 1.0
C C:ASN423 3.6 144.9 1.0
CB C:ASP439 3.8 140.1 1.0
CB C:ASP425 3.8 135.4 1.0
N C:ASP425 4.0 135.1 1.0
N C:ASP421 4.1 137.0 1.0
O C:ASP436 4.1 137.7 1.0
CB C:ASP436 4.1 135.1 1.0
N C:GLY420 4.2 137.0 1.0
CA C:ILE419 4.2 124.1 1.0
N C:ASN423 4.2 145.1 1.0
N C:ILE419 4.3 123.9 1.0
CB C:ASP421 4.4 138.6 1.0
CA C:ASN423 4.4 144.1 1.0
OD1 C:ASP439 4.4 141.2 1.0
CA C:LYS418 4.4 116.1 1.0
OD1 C:ASP425 4.5 133.0 1.0
C C:CYS424 4.5 140.6 1.0
N C:CYS424 4.5 141.8 1.0
CA C:ASP425 4.6 135.4 1.0
CB C:LYS418 4.6 118.2 1.0
C C:ILE419 4.6 127.6 1.0
CA C:CYS424 4.6 142.1 1.0
CA C:ASP421 4.7 138.2 1.0
ND2 C:ASN423 4.8 143.8 1.0
CB C:ASN423 4.8 142.8 1.0
N C:GLU422 4.8 147.9 1.0
C C:ASP421 4.9 140.9 1.0
C C:ASP436 5.0 135.4 1.0
CA C:ASP436 5.0 134.1 1.0

Calcium binding site 2 out of 8 in 8a7d

Go back to Calcium Binding Sites List in 8a7d
Calcium binding site 2 out of 8 in the Partial Dimer Complex of Papp-A and Its Inhibitor STC2


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 2 of Partial Dimer Complex of Papp-A and Its Inhibitor STC2 within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Ca1710

b:94.2
occ:1.00
OD1 C:ASP598 2.3 94.7 1.0
OE2 C:GLU589 2.3 109.5 1.0
O C:CYS600 2.4 80.1 1.0
O C:THR603 2.4 84.9 1.0
OG1 C:THR603 2.5 80.3 1.0
OE1 C:GLU589 2.8 108.7 1.0
CD C:GLU589 2.9 108.7 1.0
CG C:ASP598 3.1 89.2 1.0
OD2 C:ASP598 3.2 89.4 1.0
C C:THR603 3.5 85.5 1.0
C C:CYS600 3.6 78.3 1.0
CB C:THR603 3.7 81.3 1.0
CA C:THR603 4.0 82.8 1.0
N C:CYS600 4.2 72.2 1.0
N C:THR603 4.2 81.0 1.0
CA C:CYS600 4.3 74.3 1.0
CG C:GLU589 4.3 108.5 1.0
O C:ASN601 4.3 89.2 1.0
N C:ASP598 4.5 85.5 1.0
CB C:CYS600 4.5 71.3 1.0
CB C:ASP598 4.5 80.7 1.0
N C:ASN601 4.6 81.8 1.0
C C:ASN601 4.7 84.2 1.0
N C:ASN604 4.7 106.6 1.0
O C:THR596 4.7 84.7 1.0
O C:SER593 4.7 90.6 1.0
CA C:ASN601 4.7 82.2 1.0
C C:ASN604 4.8 109.9 1.0
O C:ASN604 4.8 110.9 1.0
CA C:PRO592 4.9 103.8 1.0
CG2 C:THR603 4.9 80.4 1.0
CA C:ASP598 4.9 77.4 1.0
N C:SER593 5.0 91.7 1.0
N C:LEU599 5.0 71.1 1.0

Calcium binding site 3 out of 8 in 8a7d

Go back to Calcium Binding Sites List in 8a7d
Calcium binding site 3 out of 8 in the Partial Dimer Complex of Papp-A and Its Inhibitor STC2


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 3 of Partial Dimer Complex of Papp-A and Its Inhibitor STC2 within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Ca1711

b:185.8
occ:1.00
OD2 C:ASP469 2.3 170.5 1.0
OD1 C:ASP458 2.4 181.4 1.0
CG C:ASP469 2.7 171.2 1.0
CB C:CYS461 3.0 178.8 1.0
OD1 C:ASP469 3.2 171.7 1.0
N C:ASP458 3.3 181.1 1.0
CG C:ASP458 3.4 182.4 1.0
SG C:CYS461 3.5 181.1 1.0
CB C:ASP469 3.6 170.8 1.0
O C:VAL456 3.7 174.9 1.0
C C:CYS457 3.7 170.3 1.0
CA C:CYS461 4.1 178.1 1.0
OD2 C:ASP458 4.1 182.2 1.0
N C:CYS461 4.1 177.6 1.0
CA C:CYS457 4.2 170.1 1.0
OD1 C:ASN454 4.2 183.3 1.0
CB C:ASP458 4.3 182.3 1.0
CA C:ASP458 4.3 180.9 1.0
SG C:CYS473 4.5 161.2 1.0
O C:LYS451 4.6 187.5 1.0
C C:CYS461 4.6 178.3 1.0
N C:MET459 4.7 165.5 1.0
O C:CYS457 4.7 169.7 1.0
C C:VAL456 4.7 174.8 1.0
OE1 C:GLU472 4.7 169.2 1.0
CA C:ASP469 4.8 170.8 1.0
CG C:ASN454 4.9 183.3 1.0
N C:CYS457 4.9 169.2 1.0
ND2 C:ASN454 4.9 183.4 1.0
C C:ASP458 5.0 179.5 1.0

Calcium binding site 4 out of 8 in 8a7d

Go back to Calcium Binding Sites List in 8a7d
Calcium binding site 4 out of 8 in the Partial Dimer Complex of Papp-A and Its Inhibitor STC2


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 4 of Partial Dimer Complex of Papp-A and Its Inhibitor STC2 within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Ca1712

b:33.7
occ:1.00
OD1 C:ASP748 2.3 56.5 1.0
O C:GLU742 2.3 54.8 1.0
O C:ASP865 2.5 41.5 1.0
O C:ARG758 2.7 51.0 1.0
OD1 C:ASP865 2.9 60.3 1.0
CG C:ASP748 3.0 57.6 1.0
OD2 C:ASP748 3.1 63.0 1.0
C C:GLU742 3.5 48.3 1.0
C C:ASP865 3.6 41.5 1.0
C C:ARG758 3.9 48.5 1.0
O C:GLU744 4.0 55.1 1.0
CG C:ASP865 4.0 55.4 1.0
CA C:ASP865 4.2 37.0 1.0
CD C:LYS535 4.2 54.2 1.0
N C:ASP748 4.2 37.8 1.0
O C:HIS746 4.4 57.8 1.0
CB C:ARG758 4.4 44.5 1.0
CA C:ALA743 4.4 32.9 1.0
N C:ALA743 4.4 33.7 1.0
CB C:ASP748 4.4 49.1 1.0
CA C:GLU742 4.5 46.9 1.0
CA C:ARG758 4.6 47.3 1.0
N C:ALA866 4.7 31.9 1.0
CB C:ALA866 4.7 35.8 1.0
CB C:ASP865 4.7 39.2 1.0
CA C:PRO747 4.8 31.0 1.0
N C:THR759 4.8 42.0 1.0
C C:ALA743 4.8 35.0 1.0
N C:GLU744 4.8 44.9 1.0
OD2 C:ASP865 4.8 55.3 1.0
CB C:GLU742 4.9 50.9 1.0
CA C:ASP748 4.9 37.3 1.0
CA C:THR759 4.9 40.2 1.0
C C:PRO747 4.9 41.7 1.0
OE1 C:GLU742 5.0 65.5 1.0

Calcium binding site 5 out of 8 in 8a7d

Go back to Calcium Binding Sites List in 8a7d
Calcium binding site 5 out of 8 in the Partial Dimer Complex of Papp-A and Its Inhibitor STC2


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 5 of Partial Dimer Complex of Papp-A and Its Inhibitor STC2 within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Ca1713

b:52.8
occ:1.00
OD2 C:ASP961 2.2 55.6 1.0
OE1 C:GLU958 2.2 61.7 1.0
O C:TYR946 2.2 70.6 1.0
OD1 C:ASP949 2.3 60.5 1.0
O C:ILE951 2.4 61.4 1.0
OE2 C:GLU958 2.4 71.6 1.0
OE1 C:GLN953 2.6 74.2 1.0
CD C:GLU958 2.6 62.0 1.0
CG C:ASP949 3.3 65.6 1.0
C C:TYR946 3.4 64.1 1.0
CG C:ASP961 3.4 60.0 1.0
CD C:GLN953 3.5 74.2 1.0
C C:ILE951 3.6 56.6 1.0
OD2 C:ASP949 3.6 66.5 1.0
NE2 C:GLN953 3.9 75.5 1.0
CA C:CYS947 4.0 56.6 1.0
CB C:ASP961 4.1 55.8 1.0
N C:CYS947 4.1 52.4 1.0
CG C:GLU958 4.1 61.3 1.0
N C:GLY948 4.2 54.4 1.0
N C:GLN953 4.2 68.1 1.0
N C:ILE951 4.3 61.1 1.0
N C:TYR946 4.3 70.6 1.0
N C:ASP949 4.3 62.3 1.0
OD1 C:ASP961 4.4 61.0 1.0
CA C:ILE951 4.5 61.3 1.0
CA C:TYR946 4.5 66.6 1.0
N C:ILE952 4.6 56.0 1.0
C C:CYS947 4.6 58.0 1.0
CB C:ASP949 4.6 60.9 1.0
CA C:ILE952 4.6 59.0 1.0
CG C:GLN953 4.7 67.9 1.0
CB C:GLN953 4.7 67.6 1.0
CB C:GLU958 4.8 62.5 1.0
SG C:CYS975 4.8 75.7 1.0
N C:GLY950 4.9 63.3 1.0
CB C:ILE951 4.9 58.5 1.0
CA C:ASP949 4.9 59.5 1.0
C C:ILE952 5.0 63.1 1.0

Calcium binding site 6 out of 8 in 8a7d

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Calcium binding site 6 out of 8 in the Partial Dimer Complex of Papp-A and Its Inhibitor STC2


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 6 of Partial Dimer Complex of Papp-A and Its Inhibitor STC2 within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Ca1714

b:31.9
occ:1.00
OD2 C:ASP969 2.3 61.1 1.0
OD1 C:ASP969 2.3 60.4 1.0
OD2 C:ASP962 2.3 57.8 1.0
O C:ILE966 2.5 52.9 1.0
O C:CYS971 2.6 50.8 1.0
CG C:ASP969 2.6 60.0 1.0
ND2 C:ASN964 3.1 48.5 1.0
CG C:ASP962 3.1 55.5 1.0
OD1 C:ASP962 3.2 61.7 1.0
C C:ILE966 3.6 53.2 1.0
C C:CYS971 3.7 51.3 1.0
N C:ILE966 3.9 51.0 1.0
O C:ASN964 3.9 60.2 1.0
CG C:ASN964 3.9 49.2 1.0
CB C:ASP969 4.1 51.3 1.0
CA C:ILE966 4.2 47.8 1.0
CB C:CYS971 4.3 45.0 1.0
O C:SER972 4.3 56.0 1.0
C C:ASN964 4.4 53.8 1.0
CB C:ASN964 4.4 46.9 1.0
CA C:CYS971 4.4 53.0 1.0
N C:CYS971 4.6 56.4 1.0
CB C:ASP962 4.6 47.2 1.0
C C:SER972 4.6 51.4 1.0
CB C:ILE966 4.6 49.7 1.0
N C:ASN967 4.7 45.6 1.0
OD1 C:ASN964 4.8 54.6 1.0
N C:SER972 4.8 53.7 1.0
N C:LYS965 4.9 56.7 1.0
C C:LYS965 4.9 47.5 1.0
CA C:ASN967 4.9 44.2 1.0
N C:ASP969 4.9 55.1 1.0
CA C:ASP969 5.0 43.0 1.0
CA C:ASN964 5.0 42.7 1.0

Calcium binding site 7 out of 8 in 8a7d

Go back to Calcium Binding Sites List in 8a7d
Calcium binding site 7 out of 8 in the Partial Dimer Complex of Papp-A and Its Inhibitor STC2


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 7 of Partial Dimer Complex of Papp-A and Its Inhibitor STC2 within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Ca1715

b:120.4
occ:1.00
OE1 C:GLU1003 2.3 134.5 1.0
OD1 C:ASP996 2.4 93.9 1.0
O C:HIS993 2.4 83.7 1.0
OE1 C:GLU1000 2.5 135.3 1.0
O C:VAL998 2.5 121.7 1.0
CD C:GLU1003 2.7 131.3 1.0
OD2 C:ASP1010 2.7 120.6 1.0
OE2 C:GLU1003 2.9 129.1 1.0
CD C:GLU1000 3.1 133.4 1.0
OE2 C:GLU1000 3.1 130.3 1.0
CG C:ASP996 3.4 91.1 1.0
C C:HIS993 3.4 77.8 1.0
CG C:ASP1010 3.7 122.5 1.0
C C:VAL998 3.7 121.0 1.0
CB C:HIS993 3.8 77.2 1.0
CG C:GLU1003 3.9 130.0 1.0
OD2 C:ASP996 3.9 91.9 1.0
CA C:HIS993 3.9 75.1 1.0
CB C:ASP1010 4.2 126.5 1.0
N C:ASP996 4.4 95.3 1.0
CA C:CYS999 4.4 139.8 1.0
N C:GLY995 4.4 92.2 1.0
CB C:ASP996 4.5 88.7 1.0
CG C:GLU1000 4.5 131.7 1.0
N C:CYS999 4.5 138.5 1.0
N C:ASP994 4.6 81.6 1.0
N C:VAL998 4.7 123.2 1.0
CB C:GLU1003 4.7 131.8 1.0
OD1 C:ASP1010 4.7 120.9 1.0
CG C:HIS993 4.7 76.4 1.0
N C:GLU1000 4.7 133.8 1.0
CA C:VAL998 4.7 121.5 1.0
CD2 C:HIS993 4.8 81.1 1.0
C C:CYS999 4.8 140.6 1.0
CA C:ASP994 4.9 87.4 1.0
CA C:ASP996 4.9 92.7 1.0

Calcium binding site 8 out of 8 in 8a7d

Go back to Calcium Binding Sites List in 8a7d
Calcium binding site 8 out of 8 in the Partial Dimer Complex of Papp-A and Its Inhibitor STC2


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 8 of Partial Dimer Complex of Papp-A and Its Inhibitor STC2 within 5.0Å range:
probe atom residue distance (Å) B Occ
Q:Ca1702

b:166.1
occ:1.00
OD1 Q:ASP1568 2.2 152.9 1.0
O Q:PHE1561 2.2 149.4 1.0
O Q:TYR1566 2.3 137.6 1.0
OD1 Q:ASP1579 2.3 162.0 1.0
OD2 Q:ASP1579 2.4 160.3 1.0
CG Q:ASP1579 2.7 160.3 1.0
OD2 Q:ASP1582 2.7 153.2 1.0
OD1 Q:ASP1564 2.8 146.6 1.0
C Q:PHE1561 3.2 148.8 1.0
CG Q:ASP1568 3.4 152.5 1.0
C Q:TYR1566 3.5 136.3 1.0
CB Q:PHE1561 3.6 148.8 1.0
CG Q:ASP1564 3.8 145.9 1.0
CG Q:ASP1582 3.8 153.4 1.0
OD2 Q:ASP1568 3.9 155.4 1.0
N Q:MET1562 4.0 150.9 1.0
CA Q:PHE1561 4.1 149.4 1.0
N Q:ASP1568 4.1 150.4 1.0
OD2 Q:ASP1564 4.1 146.4 1.0
CA Q:MET1562 4.2 152.3 1.0
CB Q:ASP1579 4.2 159.3 1.0
O Q:ASP1579 4.2 160.7 1.0
CB Q:ASP1582 4.2 152.5 1.0
CA Q:TYR1566 4.3 136.2 1.0
N Q:TYR1566 4.4 136.3 1.0
CB Q:TYR1566 4.4 136.1 1.0
N Q:GLY1563 4.4 151.0 1.0
N Q:CYS1567 4.4 144.0 1.0
CB Q:ASP1568 4.5 150.9 1.0
N Q:ASP1564 4.6 146.1 1.0
C Q:MET1562 4.6 151.7 1.0
CA Q:CYS1567 4.6 145.3 1.0
C Q:CYS1567 4.8 145.8 1.0
ND2 Q:ASN1571 4.9 155.9 1.0
OD1 Q:ASP1582 4.9 153.5 1.0
CA Q:ASP1568 4.9 151.0 1.0
CA Q:ASP1579 4.9 160.4 1.0
CB Q:ASP1564 5.0 144.5 1.0
C Q:ASP1579 5.0 160.6 1.0

Reference:

S.D.Kobbero, M.Gajhede, O.A.Mirza, S.Kloverpris, T.R.Kjaer, J.H.Mikkelsen, T.Boesen, C.Oxvig. Structure of the Proteolytic Enzyme Papp-A with the Endogenous Inhibitor Stanniocalcin-2 Reveals Its Inhibitory Mechanism. Nat Commun V. 13 6084 2022.
ISSN: ESSN 2041-1723
PubMed: 36257932
DOI: 10.1038/S41467-022-33698-8
Page generated: Fri Jul 19 06:48:03 2024

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