Mitogen-activated protein kinase kinase kinase 14
Intramolecular
Cysteine 583 and cysteine 584
Cysteine 486 and cysteine 622
Cysteine 486 and cysteine 593
Cysteine 444 and cysteine 533
Cysteine 444 and cysteine 540
4g3d E 583 E 584
A redox-regulated disulphide may form within Mitogen-activated protein kinase kinase kinase 14 between cysteines 583 and 584. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?
Details
Redox score ?
40
PDB code
4g3d
Structure name
crystal structure of human nf-kappab inducing kinase (nik)
Structure deposition date
2012-07-13
Thiol separation (Å)
7
Half-sphere exposure sum ?
91
Minimum pKa ?
12
% buried
89
Peptide accession
Q99558
Residue number A
583
Residue number B
584
Peptide name
Mitogen-activated protein kinase kinase kinase 14
Ligandability
Cysteine 583 of Mitogen-activated protein kinase kinase kinase 14
Cysteine 584 of Mitogen-activated protein kinase kinase kinase 14
4idt B 486 B 622
A redox-regulated disulphide may form within Mitogen-activated protein kinase kinase kinase 14 between cysteines 486 and 622. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?
Details
Redox score ?
37
PDB code
4idt
Structure name
crystal structure of nik with 11-bromo-5,6,7,8-tetrahydropyrimido[4', 5':3,4]cyclohepta[1,2-b]indol-2-amine (t28)
Structure deposition date
2012-12-13
Thiol separation (Å)
10
Half-sphere exposure sum ?
62
Minimum pKa ?
10
% buried
48
Peptide accession
Q99558
Residue number A
486
Residue number B
622
Peptide name
Mitogen-activated protein kinase kinase kinase 14
Ligandability
Cysteine 486 of Mitogen-activated protein kinase kinase kinase 14
Cysteine 622 of Mitogen-activated protein kinase kinase kinase 14
4idv B 486 B 593
A redox-regulated disulphide may form within Mitogen-activated protein kinase kinase kinase 14 between cysteines 486 and 593. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?
Details
Redox score ?
37
PDB code
4idv
Structure name
crystal structure of nik with compound 4-{3-[2-amino-5-(2- methoxyethoxy)pyrimidin-4-yl]-1h-indol-5-yl}-2-methylbut-3-yn-2-ol (13v)
Structure deposition date
2012-12-13
Thiol separation (Å)
9
Half-sphere exposure sum ?
72
Minimum pKa ?
10
% buried
52
Peptide accession
Q99558
Residue number A
486
Residue number B
593
Peptide name
Mitogen-activated protein kinase kinase kinase 14
Ligandability
Cysteine 486 of Mitogen-activated protein kinase kinase kinase 14
Cysteine 593 of Mitogen-activated protein kinase kinase kinase 14
4g3d A 444 A 533
A redox-regulated disulphide may form within Mitogen-activated protein kinase kinase kinase 14 between cysteines 444 and 533. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?
Details
Redox score ?
35
PDB code
4g3d
Structure name
crystal structure of human nf-kappab inducing kinase (nik)
Structure deposition date
2012-07-13
Thiol separation (Å)
9
Half-sphere exposure sum ?
96
Minimum pKa ?
10
% buried
100
Peptide accession
Q99558
Residue number A
444
Residue number B
533
Peptide name
Mitogen-activated protein kinase kinase kinase 14
Ligandability
Cysteine 444 of Mitogen-activated protein kinase kinase kinase 14
Cysteine 533 of Mitogen-activated protein kinase kinase kinase 14
4idt B 444 B 540
A redox-regulated disulphide may form within Mitogen-activated protein kinase kinase kinase 14 between cysteines 444 and 540. However, the redox score of this cysteine pair is lower than any known redox-active intermolecular disulphide. ?
Details
Redox score ?
33
PDB code
4idt
Structure name
crystal structure of nik with 11-bromo-5,6,7,8-tetrahydropyrimido[4', 5':3,4]cyclohepta[1,2-b]indol-2-amine (t28)
Structure deposition date
2012-12-13
Thiol separation (Å)
10
Half-sphere exposure sum ?
77
Minimum pKa ?
11
% buried
76
Peptide accession
Q99558
Residue number A
444
Residue number B
540
Peptide name
Mitogen-activated protein kinase kinase kinase 14
Ligandability
Cysteine 444 of Mitogen-activated protein kinase kinase kinase 14
Cysteine 540 of Mitogen-activated protein kinase kinase kinase 14
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