ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Kin of IRRE-like protein 3

Intramolecular
Cysteine 69 and cysteine 127
Cysteine 440 and cysteine 499
A redox-regulated disulphide may form within Kin of IRRE-like protein 3 between cysteines 69 and 127.

Details

Redox score ?
79
PDB code
7lu6
Structure name
crystal structure of the mouse kirrel3 d1 homodimer
Structure deposition date
2021-02-21
Thiol separation (Å)
2
Half-sphere exposure sum ?
89
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q8BR86
Residue number A
69
Residue number B
127
Peptide name
Kin of IRRE-like protein 3

Ligandability

Cysteine 69 of Kin of IRRE-like protein 3

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 Kin of IRRE-like protein 3

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 Kin of IRRE-like protein 3 between cysteines 440 and 499 (35 and 94 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
60
PDB code
2cry
Structure name
solution structure of the fifth ig-like domain of human kin of irre like 3
Structure deposition date
2005-05-20
Thiol separation (Å)
5
Half-sphere exposure sum ?
81
Minimum pKa ?
12
% buried
78
Peptide accession
Q8IZU9
Residue number A
440
Residue number B
499
Peptide name
Kin of IRRE-like protein 3

Ligandability

Cysteine 440 of Kin of IRRE-like protein 3

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 499 of Kin of IRRE-like protein 3

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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