ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

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Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 1

Intramolecular
Cysteine 155 and cysteine 185
Cysteine 14 and cysteine 155
A redox-regulated disulphide may form within Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 1 between cysteines 155 and 185.

Details

Redox score ?
64
PDB code
1kqn
Structure name
crystal structure of nmn/namn adenylyltransferase complexed with nad
Structure deposition date
2002-01-07
Thiol separation (Å)
4
Half-sphere exposure sum ?
82
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q9HAN9
Residue number A
155
Residue number B
185
Peptide name
Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 1

Ligandability

Cysteine 155 of Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 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 185 of Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 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.

A redox-regulated disulphide may form within Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 1 between cysteines 14 and 155. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
35
PDB code
1kqn
Structure name
crystal structure of nmn/namn adenylyltransferase complexed with nad
Structure deposition date
2002-01-07
Thiol separation (Å)
10
Half-sphere exposure sum ?
76
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q9HAN9
Residue number A
14
Residue number B
155
Peptide name
Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 1

Ligandability

Cysteine 14 of Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 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 155 of Nicotinamide/nicotinic acid mononucleotide adenylyltransferase 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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