BMRB

Biological Magnetic Resonance Data Bank


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

ALA CA Chemical Shift Outliers

Average chemical shift: 53.163
Standard deviation: 2.758

Low-field shifts outside of three standard deviations from the average
Entry IDComp. index IDAtom IDChemical Shift ValueAmbiguity code
409721CA63.51
423028CA67.2
42321CA68.711
423210CA66.701
423212CA67.101
423212CA78.101
423220CA71.141
423224CA65.851
423225CA65.871
423231CA65.771
423260CA66.031
42328CA61.761
42328CA72.761
423290CA99.001
44864CA61.461
5219260CA631
5997101CA65.5161
643364CA62.061
687826CA65.33
728036CA61.791
15091123CA78.3261
1631824CA84.841
16729108CA63.3151
16729123CA61.4951
16729166CA64.9971
16729315CA62.3981
1672951CA65.6451
1672991CA63.1651
1675077CA63.541
1675077CA63.551
1675077CA63.561
1675077CA63.611
1675077CA63.621
16919102CA61.5351
1749525CA70.1891
1791456CA123.901
19458132CA63.2116
2544211CA353.052
2544233CA354.698
254425CA350.079
25572130CA62.8361
2576117CA62.360
2671624CA67.0221
2710859CA64.201
5002285CA61.513
5002712CA72.2521

High-field shifts outside of three standard deviations from the average
Entry IDComp. index IDAtom IDChemical Shift ValueAmbiguity code
443181CA43.01
4901109CA44.221
526334CA42.817
55929CA40.671
680318CA17.2941
1103562CA17.0531
1103566CA20.5981
1103762CA17.0071
1103766CA20.5651
1587313CA36.7171
1587341CA35.4511
1587351CA33.0701
1587354CA36.7791
1587363CA35.7101
1587413CA36.7171
1587441CA35.4511
1587451CA33.0701
1587454CA36.7791
1587463CA35.7101
1698464CA44.7841
1749526CA36.3671
18321206CA40.19611
18333206CA40.19611
1895125CA28.6551
1895131CA27.9851
1895134CA29.7051
1895144CA26.7181
189517CA26.3751
1906336CA43.723
1906346CA41.235
1906353CA44
1906371CA44.069
1906374CA44.414
1906393CA42.064
1906399CA39.922
19616203CA42.8551
2545326CA41.7221
26557140CA20.1
2679367CA44.61
277522CA42.81
5001072CA43.9941
5001172CA44.3331