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Zinc in PDB 7r1a: Furin Cleaved Alpha Variant Sars-Cov-2 Spike in Complex with 3 ACE2

Enzymatic activity of Furin Cleaved Alpha Variant Sars-Cov-2 Spike in Complex with 3 ACE2

All present enzymatic activity of Furin Cleaved Alpha Variant Sars-Cov-2 Spike in Complex with 3 ACE2:
3.4.17.23;

Zinc Binding Sites:

The binding sites of Zinc atom in the Furin Cleaved Alpha Variant Sars-Cov-2 Spike in Complex with 3 ACE2 (pdb code 7r1a). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 3 binding sites of Zinc where determined in the Furin Cleaved Alpha Variant Sars-Cov-2 Spike in Complex with 3 ACE2, PDB code: 7r1a:
Jump to Zinc binding site number: 1; 2; 3;

Zinc binding site 1 out of 3 in 7r1a

Go back to Zinc Binding Sites List in 7r1a
Zinc binding site 1 out of 3 in the Furin Cleaved Alpha Variant Sars-Cov-2 Spike in Complex with 3 ACE2


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Furin Cleaved Alpha Variant Sars-Cov-2 Spike in Complex with 3 ACE2 within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Zn901

b:432.7
occ:1.00
OE1 D:GLU402 2.2 366.5 1.0
NE2 D:HIS378 2.3 363.9 1.0
NE2 D:HIS374 2.3 366.5 1.0
CE1 D:HIS378 2.6 363.9 1.0
OE2 D:GLU402 2.8 366.5 1.0
CD D:GLU402 2.8 366.5 1.0
CD2 D:HIS374 3.1 366.5 1.0
CE1 D:HIS374 3.4 366.5 1.0
CD2 D:HIS378 3.5 363.9 1.0
ND1 D:HIS378 3.8 363.9 1.0
CG D:HIS378 4.2 363.9 1.0
CG D:GLU402 4.3 366.5 1.0
CG D:HIS374 4.3 366.5 1.0
ND1 D:HIS374 4.4 366.5 1.0
OE1 D:GLU375 4.6 362.8 1.0
CB D:GLU402 4.8 366.5 1.0
CA D:GLU402 4.8 366.5 1.0

Zinc binding site 2 out of 3 in 7r1a

Go back to Zinc Binding Sites List in 7r1a
Zinc binding site 2 out of 3 in the Furin Cleaved Alpha Variant Sars-Cov-2 Spike in Complex with 3 ACE2


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Furin Cleaved Alpha Variant Sars-Cov-2 Spike in Complex with 3 ACE2 within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Zn901

b:432.7
occ:1.00
OE1 E:GLU402 2.2 366.5 1.0
NE2 E:HIS378 2.3 363.9 1.0
NE2 E:HIS374 2.3 366.5 1.0
CE1 E:HIS378 2.6 363.9 1.0
OE2 E:GLU402 2.8 366.5 1.0
CD E:GLU402 2.8 366.5 1.0
CD2 E:HIS374 3.1 366.5 1.0
CE1 E:HIS374 3.4 366.5 1.0
CD2 E:HIS378 3.5 363.9 1.0
ND1 E:HIS378 3.8 363.9 1.0
CG E:HIS378 4.2 363.9 1.0
CG E:GLU402 4.3 366.5 1.0
CG E:HIS374 4.3 366.5 1.0
ND1 E:HIS374 4.4 366.5 1.0
OE1 E:GLU375 4.6 362.8 1.0
CB E:GLU402 4.8 366.5 1.0
CA E:GLU402 4.8 366.5 1.0

Zinc binding site 3 out of 3 in 7r1a

Go back to Zinc Binding Sites List in 7r1a
Zinc binding site 3 out of 3 in the Furin Cleaved Alpha Variant Sars-Cov-2 Spike in Complex with 3 ACE2


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 3 of Furin Cleaved Alpha Variant Sars-Cov-2 Spike in Complex with 3 ACE2 within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Zn901

b:432.7
occ:1.00
OE1 F:GLU402 2.2 366.5 1.0
NE2 F:HIS378 2.3 363.9 1.0
NE2 F:HIS374 2.3 366.5 1.0
CE1 F:HIS378 2.6 363.9 1.0
OE2 F:GLU402 2.8 366.5 1.0
CD F:GLU402 2.8 366.5 1.0
CD2 F:HIS374 3.1 366.5 1.0
CE1 F:HIS374 3.4 366.5 1.0
CD2 F:HIS378 3.5 363.9 1.0
ND1 F:HIS378 3.8 363.9 1.0
CG F:HIS378 4.2 363.9 1.0
CG F:GLU402 4.3 366.5 1.0
CG F:HIS374 4.3 366.5 1.0
ND1 F:HIS374 4.4 366.5 1.0
OE1 F:GLU375 4.6 362.8 1.0
CB F:GLU402 4.8 366.5 1.0
CA F:GLU402 4.8 366.5 1.0

Reference:

A.G.Wrobel, D.J.Benton, C.Roustan, A.Borg, S.Hussain, S.R.Martin, P.B.Rosenthal, J.J.Skehel, S.J.Gamblin. Evolution of the Sars-Cov-2 Spike Protein in the Human Host. Nat Commun V. 13 1178 2022.
ISSN: ESSN 2041-1723
PubMed: 35246509
DOI: 10.1038/S41467-022-28768-W
Page generated: Wed Oct 30 10:04:41 2024

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