BMRB: 5911

NMR Solution Structure of a Peptide from the mdm-2 Binding Domain of the p53 Protein that is Selectively Cytotoxic to Cancer Cells

Authors

Rosal, R., Pincus, M.R., Brandt-Rauf, P.W., Fine, R., Wang, H.

Assembly

PNC27

Entity

1. PNC27 (polymer, Thiol state: not present), 32 monomers, 4031.727 Da Detail

PPLSQETFSD LWKLLKKWKM RRNQFWVKVQ RG

Formula weight

4031.727 Da

Exptl. method

NMR

Refine. method

torsion angle dynamics, simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 78.1 %, Completeness (bb): 75.3 % Detail

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Polymer type: polypeptide(L)

	Total	1H	13C
All	78.1 % (318 of 407)	86.2 % (206 of 239)	66.7 % (112 of 168)
Backbone	75.3 % (119 of 158)	96.8 % (61 of 63)	61.1 % (58 of 95)
Sidechain	81.8 % (229 of 280)	82.4 % (145 of 176)	80.8 % (84 of 104)
Aromatic	84.9 % (45 of 53)	85.7 % (24 of 28)	84.0 % (21 of 25)
Methyl	88.5 % (23 of 26)	92.3 % (12 of 13)	84.6 % (11 of 13)

1. PNC27

PPLSQETFSD LWKLLKKWKM RRNQFWVKVQ RG

Show sample condition

Sample

Pressure 1 atm, Temperature 310 K, pH 5.7

#	Name	Isotope labeling	Type	Concentration
1	PNC27			4 mM
2	DMSO-d6			5 %
3	sodium phosphate			10 mM
4	H2O			95 %

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Calculated from 20 models in PDB: 1Q2I, Strand ID: A Detail

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Release date

2004-03-06

Citation

NMR solution structure of a peptide from the mdm-2 binding domain of the p53 protein that is selectively cytotoxic to cancer cells
Rosal, R., Pincus, M.R., Brandt-Rauf, P.W., Fine, R.L., Michl, J., Wang, H.
Biochemistry (2004), 43, 1854-1861, PubMed 14967026 , DOI 10.1021/bi035718g , Abstract

Related entities 1. PNC27, : 1 : 1 : 5 entities Detail

Experiments performed 5 experiments Detail