ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Nuclear receptor ROR-beta

Intramolecular
Cysteine 319 and cysteine 361
Cysteine 310 and cysteine 431
A redox-regulated disulphide may form within Nuclear receptor ROR-beta between cysteines 319 and 361 (308 and 350 respectively in this structure).

Details

Redox score ?
61
PDB code
1k4w
Structure name
x-ray structure of the orphan nuclear receptor ror beta ligand-binding domain in the active conformation
Structure deposition date
2001-10-09
Thiol separation (Å)
5
Half-sphere exposure sum ?
63
Minimum pKa ?
11
% buried
84
Peptide accession
P45446
Residue number A
319
Residue number B
361
Peptide name
Nuclear receptor ROR-beta

Ligandability

Cysteine 319 of Nuclear receptor ROR-beta

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 361 of Nuclear receptor ROR-beta

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 Nuclear receptor ROR-beta between cysteines 310 and 431 (299 and 420 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
36
PDB code
1nq7
Structure name
characterization of ligands for the orphan nuclear receptor rorbeta
Structure deposition date
2003-01-21
Thiol separation (Å)
8
Half-sphere exposure sum ?
71
Minimum pKa ?
12
% buried
99
Peptide accession
P45446
Residue number A
310
Residue number B
431
Peptide name
Nuclear receptor ROR-beta

Ligandability

Cysteine 310 of Nuclear receptor ROR-beta

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 431 of Nuclear receptor ROR-beta

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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