ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Cytochrome P450 7A1

Intermolecular
Cysteine 44 and cysteine 44
Intramolecular
Cysteine 44 and cysteine 69
A redox-regulated disulphide may form between two units of Cytochrome P450 7A1 at cysteines 44 and 44. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
38
PDB code
3v8d
Structure name
crystal structure of human cyp7a1 in complex with 7-ketocholesterol
Structure deposition date
2011-12-22
Thiol separation (Å)
9
Half-sphere exposure sum ?
86
Minimum pKa ?
nan
% buried
nan
Peptide A name
Cytochrome P450 7A1
Peptide B name
Cytochrome P450 7A1
Peptide A accession
P22680
Peptide B accession
P22680
Peptide A residue number
44
Peptide B residue number
44

Ligandability

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 Cytochrome P450 7A1 between cysteines 44 and 69.

Details

Redox score ?
68
PDB code
3sn5
Structure name
crystal structure of human cyp7a1 in complex with cholest-4-en-3-one
Structure deposition date
2011-06-28
Thiol separation (Å)
4
Half-sphere exposure sum ?
71
Minimum pKa ?
nan
% buried
nan
Peptide accession
P22680
Residue number A
44
Residue number B
69
Peptide name
Cytochrome P450 7A1

Ligandability

Cysteine 44 of Cytochrome P450 7A1

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 69 of Cytochrome P450 7A1

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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