BMRBj - BMREntryMaster

Found 1 Document (1.761 seconds)

BMRB: 6726

1ZXF

Solution structure of self-sacrificing resistance protein CalC from Micromonospora echinospora

Authors

Singh, S., Thorson, J.S., Hager, M.H., Hallenga, K., Markley, J.L.

Assembly

CalC monomer

Entity

1. CalC monomer (polymer, Thiol state: not present), 155 monomers, 17883.80 Da Detail

NYDPFVRHSV TVKADRKTAF KTFLEGFPEW WPNNFRTTKV GAPLGVDKKG GRWYEIDEQG EEHTFGLIRK VDEPDTLVIG WRLNGFGRID PDNSSEFTVT FVADGQKKTR VDVEHTHFDR MGTKHAKRVR NGMDKGWPTI LQSFQDKIDE EGAKK

Formula weight

17883.8 Da

Source organism

Micromonospora echinospora

Exptl. method

NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 100.0 %, Completeness: 86.6 %, Completeness (bb): 97.5 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	86.6 % (1607 of 1856)	85.7 % (833 of 972)	85.4 % (616 of 721)	96.9 % (158 of 163)
Backbone	97.5 % (893 of 916)	97.8 % (311 of 318)	97.1 % (437 of 450)	98.0 % (145 of 148)
Sidechain	79.0 % (853 of 1080)	79.8 % (522 of 654)	77.4 % (318 of 411)	86.7 % (13 of 15)
Aromatic	14.6 % (30 of 206)	15.5 % (16 of 103)	10.2 % (10 of 98)	80.0 % (4 of 5)
Methyl	100.0 % (134 of 134)	100.0 % (67 of 67)	100.0 % (67 of 67)

1. CalC

NYDPFVRHSV TVKADRKTAF KTFLEGFPEW WPNNFRTTKV GAPLGVDKKG GRWYEIDEQG EEHTFGLIRK VDEPDTLVIG WRLNGFGRID PDNSSEFTVT FVADGQKKTR VDVEHTHFDR MGTKHAKRVR NGMDKGWPTI LQSFQDKIDE EGAKK

Show sample condition

Sample

Temperature 303 (±2) K, pH 7.3 (±0.2)

#	Name	Isotope labeling	Type	Concentration
1	CalC	[U-95% 13C; U-90% 15N]	protein	0.8 (±0.1) mM
2	NaPO4			10 mM
3	NaCl			150 mM

LACS Plot; CA

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	null	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	null	indirect	0.1013291

Referencing offset: -0.17 ppm, Outliers: 3 Detail

LACS Plot; CB

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	null	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	null	indirect	0.1013291

Referencing offset: -0.17 ppm, Outliers: 3 Detail

LACS Plot; HA

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	null	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	null	indirect	0.1013291

Referencing offset: -0.13 ppm, Outliers: 2 Detail

LACS Plot; CO

Atom type	Mol. common name	Atom group	Ref. method	Ref. type	Shift ratio
¹³C	DSS	methyl protons	null	indirect	0.2514495
¹H	DSS	methyl protons	internal	direct	1.0
¹⁵N	DSS	methyl protons	null	indirect	0.1013291

Referencing offset: 0.11 ppm, Outliers: 4 Detail

Protein Blocks Logo

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

Release date

2006-09-05

Citation

Structural insight into the self-sacrifice mechanism of enediyne resistance
Singh, S., Hager, M.H., Zhang, C., Griffith, B.R., Lee, M.S., Hallenga, K., Markley, J.L., Thorson, J.S.
ACS Chem. Biol. (2006), 1, 451-460, PubMed 17168523 , DOI 10.1021/cb6002898 , Abstract

Related entities 1. CalC monomer, : 1 : 2 : 1 entities Detail

Experiments performed 11 experiments Detail

1 1H-15N HSQC