a tool for identifying drug-targetable redox-active disulphides

Lipocalin-1

Intramolecular

Cysteine 79 and cysteine 171

A redox-regulated disulphide may form within Lipocalin-1 between cysteines 79 and 171 (61 and 153 respectively in this structure).

Details

Redox score ?

88

PDB code

Structure name

new crystal structure of human tear lipocalin in complex with 1,4- butanediol in space group p21

Structure deposition date

2008-10-20

Thiol separation (Å)

2

Half-sphere exposure sum ?

45

Minimum pK_a ?

nan

% buried

nan

Peptide accession

Residue number A

79

Residue number B

171

Peptide name

Lipocalin-1

Ligandability

Cysteine 79 of Lipocalin-1

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 171 of Lipocalin-1

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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