ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

Hexokinase-3

Intramolecular
Cysteine 691 and cysteine 710
Cysteine 671 and cysteine 678
Cysteine 678 and cysteine 691
Cysteine 678 and cysteine 710
A redox-regulated disulphide may form within Hexokinase-3 between cysteines 691 and 710.

Details

Redox score ?
69
PDB code
3hm8
Structure name
crystal structure of the c-terminal hexokinase domain of human hk3
Structure deposition date
2009-05-28
Thiol separation (Å)
4
Half-sphere exposure sum ?
88
Minimum pKa ?
8
% buried
100
Peptide accession
P52790
Residue number A
691
Residue number B
710
Peptide name
Hexokinase-3

Ligandability

Cysteine 691 of Hexokinase-3

Cysteine 710 of Hexokinase-3

A redox-regulated disulphide may form within Hexokinase-3 between cysteines 671 and 678. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
57
PDB code
3hm8
Structure name
crystal structure of the c-terminal hexokinase domain of human hk3
Structure deposition date
2009-05-28
Thiol separation (Å)
5
Half-sphere exposure sum ?
76
Minimum pKa ?
11
% buried
76
Peptide accession
P52790
Residue number A
671
Residue number B
678
Peptide name
Hexokinase-3

Ligandability

Cysteine 671 of Hexokinase-3

Cysteine 678 of Hexokinase-3

A redox-regulated disulphide may form within Hexokinase-3 between cysteines 678 and 691. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
42
PDB code
3hm8
Structure name
crystal structure of the c-terminal hexokinase domain of human hk3
Structure deposition date
2009-05-28
Thiol separation (Å)
9
Half-sphere exposure sum ?
86
Minimum pKa ?
8
% buried
92
Peptide accession
P52790
Residue number A
678
Residue number B
691
Peptide name
Hexokinase-3

Ligandability

Cysteine 678 of Hexokinase-3

Cysteine 691 of Hexokinase-3

A redox-regulated disulphide may form within Hexokinase-3 between cysteines 678 and 710. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?

Details

Redox score ?
27
PDB code
3hm8
Structure name
crystal structure of the c-terminal hexokinase domain of human hk3
Structure deposition date
2009-05-28
Thiol separation (Å)
10
Half-sphere exposure sum ?
77
Minimum pKa ?
13
% buried
92
Peptide accession
P52790
Residue number A
678
Residue number B
710
Peptide name
Hexokinase-3

Ligandability

Cysteine 678 of Hexokinase-3

Cysteine 710 of Hexokinase-3

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