ReDisulphID

a tool for identifying drug-targetable redox-active disulphides

Mucosal addressin cell adhesion molecule 1

Intramolecular
Cysteine 47 and cysteine 94
Cysteine 51 and cysteine 98
Cysteine 134 and cysteine 204
A redox-regulated disulphide may form within Mucosal addressin cell adhesion molecule 1 between cysteines 47 and 94 (25 and 72 respectively in this structure).

Details

Redox score ?
84
PDB code
4hc1
Structure name
crystal structure of a loop deleted mutant of human madcam-1 d1d2 complexed with fab 10g3
Structure deposition date
2012-09-28
Thiol separation (Å)
2
Half-sphere exposure sum ?
64
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q13477
Residue number A
47
Residue number B
94
Peptide name
Mucosal addressin cell adhesion molecule 1

Ligandability

Cysteine 47 of Mucosal addressin cell adhesion molecule 1

Cysteine 94 of Mucosal addressin cell adhesion molecule 1

A redox-regulated disulphide may form within Mucosal addressin cell adhesion molecule 1 between cysteines 51 and 98 (29 and 76 respectively in this structure).

Details

Redox score ?
84
PDB code
4hcr
Structure name
crystal structure of human madcam-1 d1d2 complexed with fab pf-547659
Structure deposition date
2012-10-01
Thiol separation (Å)
2
Half-sphere exposure sum ?
64
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q13477
Residue number A
51
Residue number B
98
Peptide name
Mucosal addressin cell adhesion molecule 1

Ligandability

Cysteine 51 of Mucosal addressin cell adhesion molecule 1

Cysteine 98 of Mucosal addressin cell adhesion molecule 1

A redox-regulated disulphide may form within Mucosal addressin cell adhesion molecule 1 between cysteines 134 and 204 (112 and 182 respectively in this structure).

Details

Redox score ?
80
PDB code
4hc1
Structure name
crystal structure of a loop deleted mutant of human madcam-1 d1d2 complexed with fab 10g3
Structure deposition date
2012-09-28
Thiol separation (Å)
2
Half-sphere exposure sum ?
82
Minimum pKa ?
nan
% buried
nan
Peptide accession
Q13477
Residue number A
134
Residue number B
204
Peptide name
Mucosal addressin cell adhesion molecule 1

Ligandability

Cysteine 134 of Mucosal addressin cell adhesion molecule 1

Cysteine 204 of Mucosal addressin cell adhesion molecule 1

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