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BMRB: 17111

2L22

Mupirocin didomain ACP

Authors

Dong, X., Williams, C., Crump, M.P., Wattana-amorn, P.

Assembly

Mupirocin didomain ACP

Entity

1. Mupirocin didomain ACP (polymer, Thiol state: all free), 212 monomers, 23732.42 Da Detail

MGSSHHHHHH SSGLVPRGSH MVADDECAQF LRQSLAAMLY CEPGQIRDGS RFLELGLDSV IAAQWIREIN KHYQLKIPAD GIYTYPVFKA FTQWVGTQLQ PTQATAAPVQ REPVATAPQP GAQASAQRES IQDYLKQSLG ELLFLDPGQL RSGAQFLDLG MDSVTGTQWM RGVSRHFSIQ LAADAIYTWP TLKSLADEVD RRVQLEHHHH HH

Formula weight

23732.42 Da

Source organism

Pseudomonas fluorescens

Exptl. method

solution NMR

Refine. method

simulated annealing

Data set

assigned_chemical_shifts

Chem. Shift Complete

Sequence coverage: 92.0 %, Completeness: 78.8 %, Completeness (bb): 87.9 % Detail

Polymer type: polypeptide(L)

	Total	¹H	¹³C	¹⁵N
All	78.8 % (1925 of 2442)	81.7 % (1033 of 1264)	73.3 % (698 of 952)	85.8 % (194 of 226)
Backbone	87.9 % (1099 of 1250)	89.0 % (381 of 428)	85.8 % (533 of 621)	92.0 % (185 of 201)
Sidechain	72.2 % (1003 of 1389)	78.0 % (652 of 836)	64.8 % (342 of 528)	36.0 % (9 of 25)
Aromatic	29.2 % (66 of 226)	53.1 % (60 of 113)	1.8 % (2 of 109)	100.0 % (4 of 4)
Methyl	90.3 % (204 of 226)	94.7 % (107 of 113)	85.8 % (97 of 113)

1. Mupirocin didomain ACP

Show sample condition

Sample

Solvent system 95% H2O/5% D2O, Pressure 1 atm, Temperature 293 K, pH 7.0, Details sodium phosphate 20 mM DTT 5 mM pH 7.0

#	Name	Isotope labeling	Concentration
1	sodium phosphate	natural abundance	20 mM
2	DTT	natural abundance	5 mM
3	H2O	natural abundance	95 %
4	H2O	natural abundance	5 %
5	Mupirocin_didomain_ACP	natural abundance	800 uM

LACS Plot; CA

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
¹³C	water	protons	37.599 ppm	na	indirect	0.2514495
¹H	water	protons	4.821 ppm	na	direct	1.0
¹⁵N	water	protons	120.19 ppm	na	indirect	0.1013291

Referencing offset: 0.01 ppm, Outliers: 4 Detail

LACS Plot; CB

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
¹³C	water	protons	37.599 ppm	na	indirect	0.2514495
¹H	water	protons	4.821 ppm	na	direct	1.0
¹⁵N	water	protons	120.19 ppm	na	indirect	0.1013291

Referencing offset: 0.01 ppm, Outliers: 4 Detail

LACS Plot; HA

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
¹³C	water	protons	37.599 ppm	na	indirect	0.2514495
¹H	water	protons	4.821 ppm	na	direct	1.0
¹⁵N	water	protons	120.19 ppm	na	indirect	0.1013291

Referencing offset: 0.09 ppm, Outliers: 1 Detail

LACS Plot; CO

Atom type	Mol. common name	Atom group	Value	Ref. method	Ref. type	Shift ratio
¹³C	water	protons	37.599 ppm	na	indirect	0.2514495
¹H	water	protons	4.821 ppm	na	direct	1.0
¹⁵N	water	protons	120.19 ppm	na	indirect	0.1013291

Referencing offset: 0.08 ppm, Outliers: 1 Detail

Protein Blocks Logo

Calculated from 20 models in PDB: 2L22, Strand ID: A Detail

Release date

2012-08-29

Citation

Structural studies on Mupirocin didomain Acyl Carrier Protein
Dong, X., Williams, C., Wattana-amorn, P., Crump, M.P.
Not known

Related entities 1. Mupirocin didomain ACP, : 1 : 1 entities Detail

Experiments performed 8 experiments Detail

1 2D 1H-15N HSQC