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Solution-state NMR of prion protein mutant V210I at pH 7
Authors
Biljan, I., Ilc, G., Giachin, G., Legname, G., Plavec, J.
Assembly
V210I
Entity
1. V210I (polymer, Thiol state: all disulfide bound), 147 monomers, 16633.37 Da Detail

GAMDPGQGGG THSQWNKPSK PKTNMKHMAG AAAAGAVVGG LGGYMLGSAM SRPIIHFGSD YEDRYYRENM HRYPNQVYYR PMDEYSNQNN FVHDCVNITI KQHTVTTTTK GENFTETDVK MMERVIEQMC ITQYERESQA YYQRGSS


Formula weight
16633.37 Da
Entity Connection
disulfide 1 Detail

IDTypeValue orderAtom ID 1Atom ID 2
1disulfidesing1:CYS95:SG1:CYS130:SG

Source organism
Homo sapiens
Exptl. method
solution NMR
Refine. method
molecular dynamics, simulated annealing
Data set
assigned_chemical_shifts
Chem. Shift Complete
Sequence coverage: 97.3 %, Completeness: 84.3 %, Completeness (bb): 77.5 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All84.3 % (1412 of 1675)90.5 % (792 of 875)74.5 % (477 of 640)89.4 % (143 of 160)
Backbone77.5 % (674 of 870)89.4 % (271 of 303)65.0 % (277 of 426)89.4 % (126 of 141)
Sidechain92.2 % (864 of 937)91.1 % (521 of 572)94.2 % (326 of 346)89.5 % (17 of 19)
Aromatic85.7 % (132 of 154)85.7 % (66 of 77)85.5 % (65 of 76)100.0 % (1 of 1)
Methyl98.1 % (102 of 104)96.2 % (50 of 52)100.0 % (52 of 52)

1. V210I

GAMDPGQGGG THSQWNKPSK PKTNMKHMAG AAAAGAVVGG LGGYMLGSAM SRPIIHFGSD YEDRYYRENM HRYPNQVYYR PMDEYSNQNN FVHDCVNITI KQHTVTTTTK GENFTETDVK MMERVIEQMC ITQYERESQA YYQRGSS

Sample

Solvent system 90% H2O/10% D2O, Pressure 1 atm, Temperature 273 K, pH 7.2, Details 20 mM Tris buffer 20 mM KCl pH 7.2


#NameIsotope labelingTypeConcentration
1V210I[U-100% 13C; U-100% 15N]0.6 mM
2H2Onatural abundance90 %
3D2O[U-2H]10 %
4Tris buffernatural abundance20 mM
5KClnatural abundance20 mM

LACS Plot; CA
Referencing offset: 0.07 ppm, Outliers: 1 Detail
LACS Plot; CB
Referencing offset: 0.07 ppm, Outliers: 1 Detail
LACS Plot; HA
Referencing offset: 0.07 ppm, Outliers: 1 Detail
Protein Blocks Logo
Calculated from 20 models in PDB: 2LV1, Strand ID: A Detail


Release date
2012-09-16
Citation
Structural rearrangements at physiological pH: nuclear magnetic resonance insights from the V210I human prion protein mutant
Biljan, I., Ilc, G., Giachin, G., Plavec, J., Legname, G.
Biochemistry (2012), 51, 7465-7474, PubMed 22947063 , DOI 10.1021/bi3009856 ,
Related entities 1. V210I, : 1 : 1 : 99 entities Detail
Interaction partners 1. V210I, : 73 interactors Detail
Experiments performed 7 experiments Detail
NMR combined restraints 4 contents Detail
Keywords Solution-state NMR structure of prion protein pathological V210I mutation at pH 7