BMRB: 7078

1H Chemical Shift Assigments for a Potent Bowman-Birk Inhibitor from Lentil seeds

Authors

Ragg, E.M., Galbusera, V., Scarafoni, A., Negri, A., Tedeschi, G., Consonni, A., Sessa, F., Duranti, M.

Assembly

LCTI monomer

Entity

1. LCTI monomer (polymer, Thiol state: all disulfide bound), 67 monomers, 7461.369 Da Detail

GDDVKSACCD TCLCTRSQPP TCRCVDVRES CHSACDKCVC AYSNPPQCQC YDTHKFCYKA CHNSEIE

Formula weight

7461.369 Da

Entity Connection

disulfide 7 Detail

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ID	Type	Value order	Atom ID 1	Atom ID 2
1	disulfide	sing	1:CYS8:SG	1:CYS61:SG
2	disulfide	sing	1:CYS9:SG	1:CYS24:SG
3	disulfide	sing	1:CYS12:SG	1:CYS57:SG
4	disulfide	sing	1:CYS14:SG	1:CYS22:SG
5	disulfide	sing	1:CYS31:SG	1:CYS38:SG
6	disulfide	sing	1:CYS35:SG	1:CYS50:SG
7	disulfide	sing	1:CYS40:SG	1:CYS48:SG

Source organism

Lens culinaris

Exptl. method

NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 98.5 %, Completeness: 97.8 %, Completeness (bb): 96.9 % Detail

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Polymer type: polypeptide(L)

	Total	1H
All	97.8 % (361 of 369)	97.8 % (361 of 369)
Backbone	96.9 % (127 of 131)	96.9 % (127 of 131)
Sidechain	98.3 % (234 of 238)	98.3 % (234 of 238)
Aromatic	100.0 % (23 of 23)	100.0 % (23 of 23)
Methyl	100.0 % (20 of 20)	100.0 % (20 of 20)

1. Bowman-Birk Inhibitor

GDDVKSACCD TCLCTRSQPP TCRCVDVRES CHSACDKCVC AYSNPPQCQC YDTHKFCYKA CHNSEIE

Show sample condition

Sample

Temperature 298 (±0.5) K, pH 3.1 (±0.1)

#	Name	Isotope labeling	Type	Concentration
1	Bowman-Birk Inhibitor		protein	1 (±0.1) mM
2	D2O			10 %
3	H2O			90 %

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Protein Blocks Logo

Calculated from 20 models in PDB: 2AIH, Strand ID: A Detail

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Release date

2006-09-07

Citation 1

Inhibitory properties and solution structure of a potent Bowman-Birk protease inhibitor from lentil (Lens culinaris, L) seeds
Ragg, E.M., Galbusera, V., Scarafoni, A., Negri, A., Tedeschi, G., Consonni, A., Sessa, F., Duranti, M.
FEBS J. (2006), 273, 4024-4039, PubMed 16889634 , DOI 10.1111/j.1742-4658.2006.05406.x , Abstract

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Citation 2

SPARKY 3
GODDARD, T.D., KNELLER, D.G.

Hide non-primary 1 citaion

Entries sharing articles Swiss-Prot: 1 entries Detail

Related entities 1. LCTI monomer, : 1 : 1 : 71 entities Detail

Experiments performed 3 experiments Detail