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Backbone 1H, 13C, and 15N chemical shift assignments of oxidized horse heart cytochrome c
Authors
Volkov, A.N., Van de Water, K., Vanwetswinkel, S., van Nuland, N.A. J.
Assembly
hCc
Entity
1. hCc (polymer, Thiol state: all other bound), 104 monomers, 11701.40 Da Detail

GDVEKGKKIF VQKCAQCHTV EKGGKHKTGP NLHGLFGRKT GQAPGFTYTD ANKNKGITWK EETLMEYLEN PKKYIPGTKM IFAGIKKKTE REDLIAYLKK ATNE


2. HEC (non-polymer), 618.503 Da
Total weight
12319.903 Da
Max. entity weight
11701.4 Da
Entity Connection
na 2 Detail

IDTypeValue orderAtom ID 1Atom ID 2
1nasing1:CYS14:SG2:HEC1:HEC
2nasing1:CYS17:SG2:HEC1:HEC

Source organism
Equus caballus
Exptl. method
SOLUTION NMR
Data set
assigned_chemical_shifts
Chem. Shift Complete1
Sequence coverage: 100.0 %, Completeness: 46.7 %, Completeness (bb): 80.6 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All46.7 % (589 of 1262)26.4 % (176 of 667)63.8 % (309 of 484)93.7 % (104 of 111)
Backbone80.6 % (487 of 604)50.0 % (102 of 204)96.3 % (289 of 300)96.0 % (96 of 100)
Sidechain25.9 % (194 of 750)16.0 % (74 of 463)40.6 % (112 of 276)72.7 % (8 of 11)
Aromatic 4.2 % (4 of 96) 8.3 % (4 of 48) 0.0 % (0 of 47) 0.0 % (0 of 1)
Methyl13.0 % (12 of 92) 6.5 % (3 of 46)19.6 % (9 of 46)

1. hCc

GDVEKGKKIF VQKCAQCHTV EKGGKHKTGP NLHGLFGRKT GQAPGFTYTD ANKNKGITWK EETLMEYLEN PKKYIPGTKM IFAGIKKKTE REDLIAYLKK ATNE

Sample #1

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 303 K, pH 6.0


#NameIsotope labelingTypeConcentration
1hCc[U-100% 13C; U-100% 15N]1 mM
2sodium phosphatenatural abundance20 mM
3sodium chloridenatural abundance100 mM
4H2Onatural abundance95 %
5D2Onatural abundance5 %
Sample #2

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 303 K, pH 6.0


#NameIsotope labelingTypeConcentration
6hCc[U-100% 13C; U-100% 15N]1 mM
7sodium phosphatenatural abundance20 mM
8H2Onatural abundance95 %
9D2Onatural abundance5 %

Chem. Shift Complete2
Sequence coverage: 92.3 %, Completeness: 34.8 %, Completeness (bb): 57.9 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All34.8 % (879 of 2524)24.4 % (326 of 1334)35.6 % (345 of 968)93.7 % (208 of 222)
Backbone57.9 % (699 of 1208)47.5 % (194 of 408)52.2 % (313 of 600)96.0 % (192 of 200)
Sidechain18.7 % (280 of 1500)14.3 % (132 of 926)23.9 % (132 of 552)72.7 % (16 of 22)
Aromatic 2.1 % (4 of 192) 4.2 % (4 of 96) 0.0 % (0 of 94) 0.0 % (0 of 2)
Methyl11.4 % (21 of 184) 7.6 % (7 of 92)15.2 % (14 of 92)

1. hCc

GDVEKGKKIF VQKCAQCHTV EKGGKHKTGP NLHGLFGRKT GQAPGFTYTD ANKNKGITWK EETLMEYLEN PKKYIPGTKM IFAGIKKKTE REDLIAYLKK ATNE

Sample #1

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 303 K, pH 6.0


#NameIsotope labelingTypeConcentration
1hCc[U-100% 13C; U-100% 15N]1 mM
2sodium phosphatenatural abundance20 mM
3sodium chloridenatural abundance100 mM
4H2Onatural abundance95 %
5D2Onatural abundance5 %
Sample #2

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 303 K, pH 6.0


#NameIsotope labelingTypeConcentration
6hCc[U-100% 13C; U-100% 15N]1 mM
7sodium phosphatenatural abundance20 mM
8H2Onatural abundance95 %
9D2Onatural abundance5 %

Release date
2012-03-13
Citation
Redox-dependent conformational changes in eukaryotic cytochromes revealed by paramagnetic NMR spectroscopy
Volkov, A.N., Vanwetswinkel, S., Van de Water, K., van Nuland, N.A. J.
J. Biomol. NMR (2012), 52, 245-256, PubMed 22318343 , DOI 10.1007/s10858-012-9607-8 ,
Related entities 1. hCc, : 1 : 27 : 2 : 1 : 169 entities Detail
Interaction partners 1. hCc, : 1 interactors Detail
Experiments performed 6 experiments Detail