Search

Structural Basis of Receptor Sulfotyrosine Recognition by a CC Chemokine: the N-terminal Region of CCR3 Bound to CCL11/Eotaxin-1
Authors
Millard, C.J., Ludeman, J.P., Canals, M., Bridgford, J.L., Hinds, M.G., Clayton, D.J., Christopoulos, A., Payne, R.J., Stone, M.J.
Assembly
N-terminal Region of CCR3 Bound to CCL11/Eotaxin-1
Entity
1. N-terminal Region of CCR3 Bound to CCL11/Eotaxin-1, entity 1 (polymer), 74 monomers, 8364.805 Da Detail

GPASVPTTCC FNLANRKIPL QRLESYRRIT SGKCPQKAVI FKTKLAKDIC ADPKKKWVQD SMKYLDQKSP TPKP


2. N-terminal Region of CCR3 Bound to CCL11/Eotaxin-1, entity 2 (polymer, Thiol state: not present), 16 monomers, 1940.021 Da Detail

VETFGTTSXX DDVGLL


Total weight
10304.826 Da
Max. entity weight
8364.805 Da
Source organism
Homo sapiens
Exptl. method
solution NMR
Refine. method
TORSION ANGLE DYNAMICS
Data set
assigned_chemical_shifts
Chem. Shift Complete
Sequence coverage: 93.3 %, Completeness: 74.3 %, Completeness (bb): 67.4 % Detail

Polymer type: polypeptide(L)

Total1H13C15N
All74.3 % (778 of 1047)86.1 % (476 of 553)57.7 % (235 of 407)77.0 % (67 of 87)
Backbone67.4 % (345 of 512)82.6 % (142 of 172)54.6 % (142 of 260)76.2 % (61 of 80)
Sidechain80.6 % (499 of 619)87.7 % (334 of 381)68.8 % (159 of 231)85.7 % (6 of 7)
Aromatic44.8 % (26 of 58)86.2 % (25 of 29) 0.0 % (0 of 28)100.0 % (1 of 1)
Methyl82.2 % (74 of 90)95.6 % (43 of 45)68.9 % (31 of 45)

1. entity 1

GPASVPTTCC FNLANRKIPL QRLESYRRIT SGKCPQKAVI FKTKLAKDIC ADPKKKWVQD SMKYLDQKSP TPKP

2. entity 2

VETFGTTSXX DDVGLL

Sample

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 313 (±0.1) K, pH 7.0 (±0.1), Details 0.2-0.4 mM 13C15N CCL11/ Eotaxin-1 in a 1:1 or binary complex with CCR3 Su1617 (residues 8-23) sulfopeptide. 20 mM sodium acetate-d6 (pH 6.5) containing 5% v/v D2O, 0.02% sodium azide as preservative and 20 uM DSS as internal standard.


#NameIsotope labelingTypeConcentration
1CCL11/Eotaxin-1[U-100% 13C; U-100% 15N]0.2 ~ 0.4 mM
2CCR3 Su1617 sulfopeptidenatural abundance0.2 ~ 0.4 mM
3H2Onatural abundance95 %
4D2O[U-100% 2H]5 %
5sodium acetate-d6[U-100% 2H]20 mM
6sodium azidenatural abundance0.02 %
7DSSnatural abundance20 uM

Protein Blocks Logo
Calculated from 20 models in PDB: 2MPM, Strand ID: A, B Detail


Release date
2014-12-07
Citation
Structural basis of receptor sulfotyrosine recognition by a CC chemokine: the N-terminal region of CCR3 bound to CCL11/eotaxin-1
Millard, C.J., Ludeman, J.P., Canals, M., Bridgford, J.L., Hinds, M.G., Clayton, D.J., Christopoulos, A., Payne, R.J., Stone, M.J.
Structure (2014), 22, 1571-1581, PubMed 25450766 , DOI 10.1016/j.str.2014.08.023 ,
Related entities 1. N-terminal Region of CCR3 Bound to CCL11/Eotaxin-1, entity 1, : 1 : 83 entities Detail
Related entities 2. N-terminal Region of CCR3 Bound to CCL11/Eotaxin-1, entity 2, : 1 : 2 : 3 entities Detail
Interaction partners 2. N-terminal Region of CCR3 Bound to CCL11/Eotaxin-1, entity 2, : 1 interactors Detail
Experiments performed 16 experiments Detail
NMR combined restraints 4 contents Detail
Keywords Chemokine, Eotaxin, CCL11, Chemokine Receptor, CCR3, Sulfopeptide, Sulfotyrosine, NMR, Structure