Search

Chemical Shifts Assignments of Human Adult Hemoglobin in the Carbonmonoxy Form
Authors
Fan, J., Yang, D.
Assembly
HbCO A
Entity
1. alpha chain (polymer, Thiol state: all free), 141 monomers, 15126.15 × 2 Da Detail

VLSPADKTNV KAAWGKVGAH AGEYGAEALE RMFLSFPTTK TYFPHFDLSH GSAQVKGHGK KVADALTNAV AHVDDMPNAL SALSDLHAHK LRVDPVNFKL LSHCLLVTLA AHLPAEFTPA VHASLDKFLA SVSTVLTSKY R


2. beta chain (polymer, Thiol state: all free), 146 monomers, 15867.00 × 2 Da Detail

VHLTPEEKSA VTALWGKVNV DEVGGEALGR LLVVYPWTQR FFESFGDLST PDAVMGNPKV KAHGKKVLGA FSDGLAHLDN LKGTFATLSE LHCDKLHVDP ENFRLLGNVL VCVLAHHFGK EFTPPVQAAY QKVVAGVANA LAHKYH


3. PROTOPORPHYRIN IX CONTAINING FE (non-polymer), na × 4 Da
Total weight
61986.3 Da
Max. entity weight
15867.0 Da
Source organism
Homo sapiens
Exptl. method
NMR
Refine. method
torsion angle dynamics
Data set
assigned_chemical_shifts
Chem. Shift Complete
Sequence coverage: 98.3 %, Completeness: 76.1 %, Completeness (bb): 79.3 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All76.1 % (2483 of 3262)78.6 % (1304 of 1659)69.6 % (910 of 1307)90.9 % (269 of 296)
Backbone79.3 % (1327 of 1674)93.2 % (522 of 560)64.7 % (544 of 841)95.6 % (261 of 273)
Sidechain75.0 % (1391 of 1855)71.2 % (782 of 1099)82.0 % (601 of 733)34.8 % (8 of 23)
Aromatic56.1 % (174 of 310)56.1 % (87 of 155)55.3 % (84 of 152)100.0 % (3 of 3)
Methyl99.7 % (371 of 372)99.5 % (185 of 186)100.0 % (186 of 186)

1. alpha chain

VLSPADKTNV KAAWGKVGAH AGEYGAEALE RMFLSFPTTK TYFPHFDLSH GSAQVKGHGK KVADALTNAV AHVDDMPNAL SALSDLHAHK LRVDPVNFKL LSHCLLVTLA AHLPAEFTPA VHASLDKFLA SVSTVLTSKY R

2. beta chain

VHLTPEEKSA VTALWGKVNV DEVGGEALGR LLVVYPWTQR FFESFGDLST PDAVMGNPKV KAHGKKVLGA FSDGLAHLDN LKGTFATLSE LHCDKLHVDP ENFRLLGNVL VCVLAHHFGK EFTPPVQAAY QKVVAGVANA LAHKYH

Sample

Temperature 308 (±0.1) K, pH 7.0


#NameIsotope labelingTypeConcentration
1HbCO A[U-13C; U-15N]1.2 mM
2HbCO A[U-13C; U-15N]1.0 mM

LACS Plot; CA
Referencing offset: -0.15 ppm, Outliers: 3 Detail
LACS Plot; CB
Referencing offset: -0.15 ppm, Outliers: 3 Detail
LACS Plot; HA
Referencing offset: 0.17 ppm, Outliers: 1 Detail
Protein Blocks Logo
Calculated from 20 models in PDB: 2M6Z, Strand ID: A, B, C, D Detail


Release date
2006-11-12
Citation
A new strategy for structure determination of large proteins in solution without deuteration
Xu, Y., Zheng, Y., Fan, J., Yang, D.
Nat. Methods (2006), 3, 931-937, PubMed 17060917 , DOI 10.1038/nmeth938 ,
Related entities 1. alpha chain, : 101 : 1 : 6 : 100 entities Detail
Related entities 2. beta chain, : 103 : 1 : 5 : 97 entities Detail
Interaction partners 1. alpha chain, : 29 : 1 interactors Detail
Interaction partners 2. beta chain, : 9 : 1 interactors Detail
Experiments performed 3 experiments Detail
Keywords hemoglobin