BMRB

Biological Magnetic Resonance Data Bank


A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

ILE CB Chemical Shift Outliers

Average chemical shift: 38.58
Standard deviation: 2.908

Low-field shifts outside of three standard deviations from the average
Entry IDComp. index IDAtom IDChemical Shift ValueAmbiguity code
4150104CB80.980
415015CB81.714
415023CB81.806
415033CB80.667
415037CB78.897
415038CB78.667
415043CB78.961
415056CB77.344
415083CB83.177
423219CB48.901
423237CB53.001
423261CB49.731
423262CB48.961
423273CB53.201
517925CB87.680
517943CB84.880
6141117CB51.876
718844CB69.5651
1558443CB55.3871
16729208CB69.8401
1764081CB66.12301
1983492CB48.652
2510825CB69.641
2538210CB68.558
2538212CB68.105
2538237CB65.935
2538243CB69.214
2538250CB67.671
2538279CB68.710
2538281CB66.894
2538283CB65.926
2544212CB339.785
2544238CB338.695
2677225CB63.5371

High-field shifts outside of three standard deviations from the average
Entry IDComp. index IDAtom IDChemical Shift ValueAmbiguity code
41365CB26.81
423968CB20.939
4313132CB29.21
447520CB29.71
467856CB28.27
4768124CB27.4
5267104CB29.681
5514167CB28.901
593592CB29.2281
658650CB29.6201
658672CB26.3629
658677CB22.1131
658699CB28.5571
6700158CB27.80
6883173CB28.4001
7308128CB28.31
7406148CB27.21
1101124CB29.7331
1149260CB27.3281
1149261CB28.3781
15120155CB28.9
15461148CB27.21
1612318CB18.11
16729129CB29.5571
1672955CB29.0451
1678713CB29.4481
1701082CB29.541
1736732CB24.7481
1834453CB27.4871
18613111CB26.2301
1906328CB24.854
1906333CB26.72
1906375CB27.826
1906388CB29.623
1932154CB26.1071
1944371CB25.880
19844105CB29.69
2557313CB28.90271
26600133CB28.8281
26601135CB28.7331
26801194CB-34.4771
2693249CB29.491
27121226CB28.268
27279135CB28.7331
2752926CB29.7271
3046992CB29.275
3613639CB28.968
50022167CB28.848
5002298CB29.132