Zinc in PDB 6u7g: Hcov-229E Rbd Class V in Complex with Human Apn
Enzymatic activity of Hcov-229E Rbd Class V in Complex with Human Apn
All present enzymatic activity of Hcov-229E Rbd Class V in Complex with Human Apn:
3.4.11.2;
Protein crystallography data
The structure of Hcov-229E Rbd Class V in Complex with Human Apn, PDB code: 6u7g
was solved by
A.Tomlinson,
Z.Li,
J.M.Rini,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
45.61 /
2.35
|
Space group
|
P 1 21 1
|
Cell size a, b, c (Å), α, β, γ (°)
|
99.555,
98.682,
147.525,
90.00,
104.60,
90.00
|
R / Rfree (%)
|
17.9 /
21.8
|
Zinc Binding Sites:
The binding sites of Zinc atom in the Hcov-229E Rbd Class V in Complex with Human Apn
(pdb code 6u7g). This binding sites where shown within
5.0 Angstroms radius around Zinc atom.
In total 2 binding sites of Zinc where determined in the
Hcov-229E Rbd Class V in Complex with Human Apn, PDB code: 6u7g:
Jump to Zinc binding site number:
1;
2;
Zinc binding site 1 out
of 2 in 6u7g
Go back to
Zinc Binding Sites List in 6u7g
Zinc binding site 1 out
of 2 in the Hcov-229E Rbd Class V in Complex with Human Apn
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 1 of Hcov-229E Rbd Class V in Complex with Human Apn within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Zn5001
b:21.8
occ:1.00
|
OE2
|
A:GLU411
|
1.9
|
30.4
|
1.0
|
NE2
|
A:HIS392
|
2.0
|
29.1
|
1.0
|
NE2
|
A:HIS388
|
2.1
|
26.0
|
1.0
|
O
|
A:HOH5463
|
2.3
|
24.2
|
1.0
|
CD
|
A:GLU411
|
2.7
|
30.0
|
1.0
|
CD2
|
A:HIS392
|
2.9
|
29.0
|
1.0
|
OE1
|
A:GLU411
|
3.0
|
29.2
|
1.0
|
HD2
|
A:HIS392
|
3.0
|
34.9
|
1.0
|
CD2
|
A:HIS388
|
3.0
|
25.5
|
1.0
|
CE1
|
A:HIS388
|
3.1
|
24.8
|
1.0
|
CE1
|
A:HIS392
|
3.1
|
29.2
|
1.0
|
HD2
|
A:HIS388
|
3.1
|
30.6
|
1.0
|
HE1
|
A:HIS388
|
3.3
|
29.7
|
1.0
|
HE2
|
A:TYR477
|
3.4
|
27.3
|
1.0
|
HE1
|
A:HIS392
|
3.4
|
35.0
|
1.0
|
HH
|
A:TYR477
|
3.4
|
32.1
|
1.0
|
HB3
|
A:ALA414
|
3.6
|
29.4
|
1.0
|
HA
|
A:GLU411
|
3.6
|
29.5
|
1.0
|
HB1
|
A:ALA414
|
3.9
|
29.4
|
1.0
|
CE2
|
A:TYR477
|
3.9
|
22.7
|
1.0
|
O
|
A:HOH5109
|
4.0
|
35.0
|
1.0
|
OH
|
A:TYR477
|
4.0
|
26.8
|
1.0
|
CB
|
A:ALA414
|
4.1
|
24.4
|
1.0
|
CG
|
A:HIS392
|
4.1
|
29.8
|
1.0
|
CG
|
A:GLU411
|
4.1
|
28.9
|
1.0
|
ND1
|
A:HIS392
|
4.2
|
30.8
|
1.0
|
CG
|
A:HIS388
|
4.2
|
25.3
|
1.0
|
ND1
|
A:HIS388
|
4.2
|
25.5
|
1.0
|
HB2
|
A:ALA414
|
4.2
|
29.4
|
1.0
|
HB3
|
A:GLU411
|
4.3
|
32.0
|
1.0
|
CZ
|
A:TYR477
|
4.3
|
22.9
|
1.0
|
OE1
|
A:GLU355
|
4.3
|
28.1
|
1.0
|
CA
|
A:GLU411
|
4.5
|
24.6
|
1.0
|
CB
|
A:GLU411
|
4.5
|
26.6
|
1.0
|
HG3
|
A:GLU411
|
4.6
|
34.7
|
1.0
|
HG2
|
A:GLU411
|
4.7
|
34.7
|
1.0
|
OE1
|
A:GLU389
|
4.8
|
32.1
|
1.0
|
CD2
|
A:TYR477
|
4.9
|
22.7
|
1.0
|
CD
|
A:GLU355
|
5.0
|
27.0
|
1.0
|
OE2
|
A:GLU355
|
5.0
|
28.9
|
1.0
|
O
|
A:HOH5194
|
5.0
|
21.8
|
1.0
|
HD1
|
A:HIS392
|
5.0
|
37.0
|
1.0
|
HD1
|
A:HIS388
|
5.0
|
30.6
|
1.0
|
|
Zinc binding site 2 out
of 2 in 6u7g
Go back to
Zinc Binding Sites List in 6u7g
Zinc binding site 2 out
of 2 in the Hcov-229E Rbd Class V in Complex with Human Apn
Mono view
Stereo pair view
|
A full contact list of Zinc with other atoms in the Zn binding
site number 2 of Hcov-229E Rbd Class V in Complex with Human Apn within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
B:Zn5001
b:21.6
occ:1.00
|
OE2
|
B:GLU411
|
1.9
|
22.3
|
1.0
|
NE2
|
B:HIS388
|
2.1
|
26.9
|
1.0
|
NE2
|
B:HIS392
|
2.1
|
20.9
|
1.0
|
O
|
B:HOH5337
|
2.1
|
28.3
|
1.0
|
CD
|
B:GLU411
|
2.8
|
27.5
|
1.0
|
OE1
|
B:GLU411
|
2.9
|
31.5
|
1.0
|
CD2
|
B:HIS388
|
3.0
|
28.4
|
1.0
|
CD2
|
B:HIS392
|
3.0
|
25.0
|
1.0
|
HD2
|
B:HIS388
|
3.1
|
34.1
|
1.0
|
CE1
|
B:HIS388
|
3.1
|
27.8
|
1.0
|
CE1
|
B:HIS392
|
3.1
|
25.4
|
1.0
|
HD2
|
B:HIS392
|
3.1
|
30.1
|
1.0
|
HE1
|
B:HIS388
|
3.3
|
33.4
|
1.0
|
HE1
|
B:HIS392
|
3.3
|
30.6
|
1.0
|
HA
|
B:GLU411
|
3.6
|
27.9
|
1.0
|
HE1
|
B:TYR477
|
3.7
|
35.3
|
1.0
|
HB3
|
B:ALA414
|
3.7
|
28.8
|
1.0
|
HH
|
B:TYR477
|
3.8
|
34.8
|
1.0
|
O
|
B:HOH5256
|
4.0
|
36.7
|
1.0
|
CG
|
B:HIS388
|
4.1
|
28.0
|
1.0
|
ND1
|
B:HIS388
|
4.2
|
28.2
|
1.0
|
CG
|
B:HIS392
|
4.2
|
24.2
|
1.0
|
CG
|
B:GLU411
|
4.2
|
28.1
|
1.0
|
HB1
|
B:ALA414
|
4.2
|
28.8
|
1.0
|
OE1
|
B:GLU355
|
4.2
|
34.8
|
1.0
|
ND1
|
B:HIS392
|
4.2
|
27.2
|
1.0
|
CB
|
B:ALA414
|
4.3
|
24.0
|
1.0
|
CE1
|
B:TYR477
|
4.4
|
29.4
|
1.0
|
HB3
|
B:GLU411
|
4.4
|
34.7
|
1.0
|
OE2
|
B:GLU389
|
4.5
|
35.1
|
1.0
|
OH
|
B:TYR477
|
4.5
|
29.0
|
1.0
|
HB2
|
B:ALA414
|
4.5
|
28.8
|
1.0
|
CA
|
B:GLU411
|
4.5
|
23.3
|
1.0
|
CB
|
B:GLU411
|
4.6
|
28.9
|
1.0
|
HG2
|
B:GLU411
|
4.7
|
33.7
|
1.0
|
HG3
|
B:GLU411
|
4.7
|
33.7
|
1.0
|
CD
|
B:GLU355
|
4.7
|
34.7
|
1.0
|
CZ
|
B:TYR477
|
4.8
|
27.3
|
1.0
|
OE2
|
B:GLU355
|
4.9
|
35.9
|
1.0
|
HB3
|
B:GLU355
|
4.9
|
36.7
|
1.0
|
HD1
|
B:HIS388
|
5.0
|
33.9
|
1.0
|
HD1
|
B:HIS392
|
5.0
|
32.7
|
1.0
|
|
Reference:
Z.Li,
A.C.A.Tomlinson,
A.H.M.Wong,
D.Zhou,
M.Desforges,
P.J.Talbot,
S.Benlekbir,
J.L.Rubinstein,
J.M.Rini.
The Human Coronavirus Hcov-229E S-Protein Structure and Receptor Binding. Elife V. 8 2019.
ISSN: ESSN 2050-084X
PubMed: 31650956
DOI: 10.7554/ELIFE.51230
Page generated: Tue Oct 29 08:27:34 2024
|