ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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NADH dehydrogenase [ubiquinone] iron-sulfur protein 7, mitochondrial

Intermolecular
Cysteine 193 and cysteine 157 of NADH dehydrogenase [ubiquinone] iron-sulfur protein 8, mitochondrial
Cysteine 193 and cysteine 160 of NADH dehydrogenase [ubiquinone] iron-sulfur protein 8, mitochondrial
A redox-regulated disulphide may form between cysteine 193 of NADH dehydrogenase [ubiquinone] iron-sulfur protein 7, mitochondrial and cysteine 157 of NADH dehydrogenase [ubiquinone] iron-sulfur protein 8, mitochondrial (149 and 116 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
40
PDB code
7zdm
Structure name
complex i from ovis aries at ph5
Structure deposition date
2022-03-29
Thiol separation (Å)
8
Half-sphere exposure sum ?
92
Minimum pKa ?
10
% buried
100
Peptide A name
NADH dehydrogenase [ubiquinone] iron-sulfur protein 7, mitochondrial
Peptide B name
NADH dehydrogenase [ubiquinone] iron-sulfur protein 8, mitochondrial
Peptide A accession
A0A7M4DUG3
Peptide B accession
A0A6P3TFB2
Peptide A residue number
193
Peptide B residue number
157

Ligandability

Cysteine 193 of NADH dehydrogenase [ubiquinone] iron-sulfur protein 7, mitochondrial

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 157 of NADH dehydrogenase [ubiquinone] iron-sulfur protein 8, mitochondrial

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 between cysteine 193 of NADH dehydrogenase [ubiquinone] iron-sulfur protein 7, mitochondrial and cysteine 160 of NADH dehydrogenase [ubiquinone] iron-sulfur protein 8, mitochondrial (149 and 119 respectively in this structure). However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
32
PDB code
7zdm
Structure name
complex i from ovis aries at ph5
Structure deposition date
2022-03-29
Thiol separation (Å)
9
Half-sphere exposure sum ?
96
Minimum pKa ?
10
% buried
100
Peptide A name
NADH dehydrogenase [ubiquinone] iron-sulfur protein 7, mitochondrial
Peptide B name
NADH dehydrogenase [ubiquinone] iron-sulfur protein 8, mitochondrial
Peptide A accession
A0A7M4DUG3
Peptide B accession
A0A6P3TFB2
Peptide A residue number
193
Peptide B residue number
160

Ligandability

Cysteine 193 of NADH dehydrogenase [ubiquinone] iron-sulfur protein 7, mitochondrial

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 160 of NADH dehydrogenase [ubiquinone] iron-sulfur protein 8, mitochondrial

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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