Chlorine in PDB 5n27: X-Ray Structure of Human Heavy Chain Ferritin (Apo Form)
Enzymatic activity of X-Ray Structure of Human Heavy Chain Ferritin (Apo Form)
All present enzymatic activity of X-Ray Structure of Human Heavy Chain Ferritin (Apo Form):
1.16.3.1;
Protein crystallography data
The structure of X-Ray Structure of Human Heavy Chain Ferritin (Apo Form), PDB code: 5n27
was solved by
G.Ferraro,
A.Merlino,
with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:
Resolution Low / High (Å)
|
105.63 /
1.74
|
Space group
|
F 4 3 2
|
Cell size a, b, c (Å), α, β, γ (°)
|
182.955,
182.955,
182.955,
90.00,
90.00,
90.00
|
R / Rfree (%)
|
14.6 /
19.1
|
Other elements in 5n27:
The structure of X-Ray Structure of Human Heavy Chain Ferritin (Apo Form) also contains other interesting chemical elements:
Chlorine Binding Sites:
The binding sites of Chlorine atom in the X-Ray Structure of Human Heavy Chain Ferritin (Apo Form)
(pdb code 5n27). This binding sites where shown within
5.0 Angstroms radius around Chlorine atom.
In total 6 binding sites of Chlorine where determined in the
X-Ray Structure of Human Heavy Chain Ferritin (Apo Form), PDB code: 5n27:
Jump to Chlorine binding site number:
1;
2;
3;
4;
5;
6;
Chlorine binding site 1 out
of 6 in 5n27
Go back to
Chlorine Binding Sites List in 5n27
Chlorine binding site 1 out
of 6 in the X-Ray Structure of Human Heavy Chain Ferritin (Apo Form)
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 1 of X-Ray Structure of Human Heavy Chain Ferritin (Apo Form) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl201
b:17.1
occ:0.25
|
NE2
|
A:HIS173
|
3.2
|
21.4
|
1.0
|
CE1
|
A:HIS173
|
3.9
|
29.4
|
1.0
|
CD2
|
A:LEU169
|
4.0
|
18.6
|
1.0
|
CD2
|
A:HIS173
|
4.3
|
20.4
|
1.0
|
CD1
|
A:LEU169
|
4.9
|
17.7
|
1.0
|
|
Chlorine binding site 2 out
of 6 in 5n27
Go back to
Chlorine Binding Sites List in 5n27
Chlorine binding site 2 out
of 6 in the X-Ray Structure of Human Heavy Chain Ferritin (Apo Form)
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 2 of X-Ray Structure of Human Heavy Chain Ferritin (Apo Form) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl202
b:23.3
occ:1.00
|
O
|
A:HOH530
|
2.9
|
53.8
|
1.0
|
O
|
A:HOH540
|
3.2
|
41.4
|
1.0
|
O
|
A:HOH502
|
3.3
|
46.8
|
1.0
|
N
|
A:TYR12
|
3.3
|
14.0
|
1.0
|
O
|
A:TYR12
|
3.4
|
14.5
|
1.0
|
N
|
A:ASN11
|
3.5
|
15.6
|
1.0
|
NE
|
A:ARG9
|
3.7
|
19.7
|
1.0
|
CG
|
A:ARG9
|
3.7
|
17.5
|
1.0
|
CD
|
A:ARG9
|
3.7
|
20.7
|
1.0
|
O
|
A:HOH470
|
3.9
|
24.9
|
1.0
|
C
|
A:GLN10
|
3.9
|
14.8
|
1.0
|
C
|
A:TYR12
|
4.0
|
14.4
|
1.0
|
CA
|
A:GLN10
|
4.0
|
15.2
|
1.0
|
O
|
A:HOH600
|
4.1
|
52.6
|
1.0
|
CA
|
A:TYR12
|
4.1
|
14.1
|
1.0
|
N
|
A:GLN10
|
4.1
|
14.4
|
1.0
|
CA
|
A:ASN11
|
4.1
|
15.3
|
1.0
|
C
|
A:ASN11
|
4.2
|
13.9
|
1.0
|
C
|
A:ARG9
|
4.4
|
16.2
|
1.0
|
CB
|
A:TYR12
|
4.4
|
14.6
|
1.0
|
CB
|
A:ARG9
|
4.5
|
15.7
|
1.0
|
O
|
A:ARG9
|
4.6
|
15.8
|
1.0
|
O
|
A:GLN10
|
4.8
|
13.7
|
1.0
|
CZ
|
A:ARG9
|
4.9
|
19.1
|
1.0
|
|
Chlorine binding site 3 out
of 6 in 5n27
Go back to
Chlorine Binding Sites List in 5n27
Chlorine binding site 3 out
of 6 in the X-Ray Structure of Human Heavy Chain Ferritin (Apo Form)
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 3 of X-Ray Structure of Human Heavy Chain Ferritin (Apo Form) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl203
b:26.6
occ:1.00
|
ND2
|
A:ASN139
|
3.3
|
18.1
|
1.0
|
O
|
A:HOH499
|
3.6
|
36.9
|
1.0
|
CD
|
A:LYS143
|
3.8
|
24.3
|
1.0
|
O
|
A:HOH366
|
3.9
|
22.9
|
1.0
|
OD1
|
A:ASN139
|
4.1
|
17.2
|
1.0
|
CG
|
A:ASN139
|
4.1
|
19.2
|
1.0
|
CG
|
A:LYS143
|
4.1
|
19.6
|
1.0
|
CE
|
A:LYS143
|
4.9
|
31.2
|
1.0
|
|
Chlorine binding site 4 out
of 6 in 5n27
Go back to
Chlorine Binding Sites List in 5n27
Chlorine binding site 4 out
of 6 in the X-Ray Structure of Human Heavy Chain Ferritin (Apo Form)
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 4 of X-Ray Structure of Human Heavy Chain Ferritin (Apo Form) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl204
b:31.2
occ:1.00
|
O
|
A:HOH502
|
3.0
|
46.8
|
1.0
|
N
|
A:GLN14
|
3.2
|
16.5
|
0.5
|
CG
|
A:GLN14
|
3.2
|
23.2
|
0.5
|
N
|
A:GLN14
|
3.2
|
15.9
|
0.5
|
O
|
A:HOH478
|
3.3
|
51.1
|
1.0
|
CG
|
A:GLN14
|
3.6
|
20.0
|
0.5
|
CD2
|
A:HIS13
|
3.8
|
18.7
|
1.0
|
CG
|
A:HIS13
|
3.8
|
17.6
|
1.0
|
CA
|
A:HIS13
|
3.8
|
15.7
|
1.0
|
CB
|
A:GLN14
|
3.9
|
19.1
|
0.5
|
NE2
|
A:HIS13
|
3.9
|
19.3
|
1.0
|
CB
|
A:GLN14
|
3.9
|
17.2
|
0.5
|
CE1
|
A:HIS13
|
3.9
|
19.5
|
1.0
|
O
|
A:HOH540
|
3.9
|
41.4
|
1.0
|
ND1
|
A:HIS13
|
3.9
|
18.1
|
1.0
|
C
|
A:HIS13
|
4.0
|
16.0
|
1.0
|
O
|
A:HOH308
|
4.1
|
40.8
|
1.0
|
CA
|
A:GLN14
|
4.1
|
17.4
|
0.5
|
CA
|
A:GLN14
|
4.1
|
16.4
|
0.5
|
CD
|
A:GLN14
|
4.2
|
23.7
|
0.5
|
OE1
|
A:GLN14
|
4.2
|
28.0
|
0.5
|
CB
|
A:HIS13
|
4.4
|
16.0
|
1.0
|
CD
|
A:GLN14
|
4.4
|
29.2
|
0.5
|
O
|
A:TYR12
|
4.6
|
14.5
|
1.0
|
NE2
|
A:GLN14
|
4.9
|
33.0
|
0.5
|
N
|
A:HIS13
|
5.0
|
14.2
|
1.0
|
|
Chlorine binding site 5 out
of 6 in 5n27
Go back to
Chlorine Binding Sites List in 5n27
Chlorine binding site 5 out
of 6 in the X-Ray Structure of Human Heavy Chain Ferritin (Apo Form)
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 5 of X-Ray Structure of Human Heavy Chain Ferritin (Apo Form) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl205
b:17.4
occ:0.15
|
CE1
|
A:HIS173
|
3.7
|
29.4
|
1.0
|
ND1
|
A:HIS173
|
4.4
|
25.8
|
1.0
|
NE2
|
A:HIS173
|
4.6
|
21.4
|
1.0
|
O
|
A:HOH562
|
4.7
|
52.0
|
1.0
|
|
Chlorine binding site 6 out
of 6 in 5n27
Go back to
Chlorine Binding Sites List in 5n27
Chlorine binding site 6 out
of 6 in the X-Ray Structure of Human Heavy Chain Ferritin (Apo Form)
 Mono view
 Stereo pair view
|
A full contact list of Chlorine with other atoms in the Cl binding
site number 6 of X-Ray Structure of Human Heavy Chain Ferritin (Apo Form) within 5.0Å range:
probe
|
atom
|
residue
|
distance (Å)
|
B
|
Occ
|
A:Cl206
b:26.5
occ:1.00
|
NE2
|
A:GLN83
|
2.7
|
26.8
|
1.0
|
N
|
A:ASP84
|
3.1
|
13.7
|
1.0
|
OD1
|
A:ASP84
|
3.5
|
14.4
|
1.0
|
CG
|
A:ASP84
|
3.5
|
15.4
|
1.0
|
CB
|
A:GLN83
|
3.7
|
16.9
|
1.0
|
CA
|
A:GLN83
|
3.7
|
15.0
|
1.0
|
CD
|
A:GLN83
|
3.9
|
30.4
|
1.0
|
OD2
|
A:ASP84
|
3.9
|
15.0
|
1.0
|
C
|
A:GLN83
|
3.9
|
13.2
|
1.0
|
CB
|
A:ASP84
|
4.0
|
13.0
|
1.0
|
O
|
A:HOH526
|
4.1
|
53.8
|
1.0
|
CA
|
A:ASP84
|
4.1
|
12.3
|
1.0
|
CG
|
A:GLN83
|
4.3
|
21.7
|
1.0
|
O
|
A:HOH322
|
4.4
|
17.2
|
1.0
|
O
|
A:HOH312
|
4.6
|
18.4
|
0.5
|
O
|
A:HOH358
|
4.9
|
17.8
|
1.0
|
OE1
|
A:GLN83
|
4.9
|
38.1
|
1.0
|
|
Reference:
G.Ferraro,
S.Ciambellotti,
L.Messori,
A.Merlino.
Cisplatin Binding Sites in Human H-Chain Ferritin. Inorg Chem V. 56 9064 2017.
ISSN: ISSN 1520-510X
PubMed: 28737381
DOI: 10.1021/ACS.INORGCHEM.7B01072
Page generated: Fri Jul 26 13:10:54 2024
|