ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Fatty acid binding protein 5, epidermal

Intramolecular
Cysteine 67 and cysteine 87
Cysteine 120 and cysteine 127
Cysteine 47 and cysteine 67
Cysteine 43 and cysteine 120
A redox-regulated disulphide may form within Fatty acid binding protein 5, epidermal between cysteines 67 and 87.

Details

Redox score ?
78
PDB code
4azo
Structure name
murine epidermal fatty acid-binding protein (fabp5), apo form, poly- his tag removed
Structure deposition date
2012-06-26
Thiol separation (Å)
4
Half-sphere exposure sum ?
62
Minimum pKa ?
7
% buried
58
Peptide accession
Q497I3
Residue number A
67
Residue number B
87
Peptide name
Fatty acid binding protein 5, epidermal

Ligandability

Cysteine 67 of Fatty acid binding protein 5, epidermal

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 87 of Fatty acid binding protein 5, epidermal

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Fatty acid binding protein 5, epidermal between cysteines 120 and 127.

Details

Redox score ?
70
PDB code
4azn
Structure name
murine epidermal fatty acid-binding protein (fabp5), apo form, poly- his tag-mediated crystal packing
Structure deposition date
2012-06-26
Thiol separation (Å)
5
Half-sphere exposure sum ?
64
Minimum pKa ?
7
% buried
74
Peptide accession
Q497I3
Residue number A
120
Residue number B
127
Peptide name
Fatty acid binding protein 5, epidermal

Ligandability

Cysteine 120 of Fatty acid binding protein 5, epidermal

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 127 of Fatty acid binding protein 5, epidermal

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Fatty acid binding protein 5, epidermal between cysteines 47 and 67. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
47
PDB code
4azn
Structure name
murine epidermal fatty acid-binding protein (fabp5), apo form, poly- his tag-mediated crystal packing
Structure deposition date
2012-06-26
Thiol separation (Å)
10
Half-sphere exposure sum ?
52
Minimum pKa ?
8
% buried
36
Peptide accession
Q497I3
Residue number A
47
Residue number B
67
Peptide name
Fatty acid binding protein 5, epidermal

Ligandability

Cysteine 47 of Fatty acid binding protein 5, epidermal

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 67 of Fatty acid binding protein 5, epidermal

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

A redox-regulated disulphide may form within Fatty acid binding protein 5, epidermal between cysteines 43 and 120. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
30
PDB code
4azn
Structure name
murine epidermal fatty acid-binding protein (fabp5), apo form, poly- his tag-mediated crystal packing
Structure deposition date
2012-06-26
Thiol separation (Å)
10
Half-sphere exposure sum ?
72
Minimum pKa ?
11
% buried
98
Peptide accession
Q497I3
Residue number A
43
Residue number B
120
Peptide name
Fatty acid binding protein 5, epidermal

Ligandability

Cysteine 43 of Fatty acid binding protein 5, epidermal

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

Cysteine 120 of Fatty acid binding protein 5, epidermal

Not ligandable in the dataset of Yang et al.

Not ligandable in the dataset of Yan et al.

Not ligandable in the dataset of Backus et al.

Not ligandable in the dataset of Vinogradova et al.

Not ligandable in the dataset of Cao et al.

Not ligandable in the dataset of Kuljanin et al.

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