Statistics Calculated for All Chemical Shifts from Atoms in the 4 Common DNA Nucleotides

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The statistics presented in this table were calculated from the full BMRB database. This includes paramagnetic proteins, proteins with aromatic prosthetic groups, and entries where chemical shifts are reported relative to uncommon chemical shift reference compounds. Shifts are considered outliers when they exceed three standard deviations from the average.

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Compound IDAtom NameNumber of ShiftsMinimum ShiftMaximum ShiftAverage ShiftStandard DeviationShift OutliersDistribution Histogram
DAH1'19144.198.506.0450.31732histogram
H216132.6018.9757.5830.66824histogram
H2'18450.8397.1942.6070.38556histogram
H2''1829-0.1296.892.7520.35433histogram
H3'17862.4696.0404.9240.20123histogram
H4'13292.0579.134.2840.42952histogram
H5'7782.725.954.0210.31316histogram
H5''7162.6318.414.0050.3897histogram
H612052.55713.407.0521.1924histogram
H621935.30712.906.9951.1565histogram
H819092.359.18.0440.65924histogram
C1'21680.48291.90384.6461.6031histogram
C2290150.82200159.328154.4041.3482histogram
C2'14536.22867.96741.1784.6504histogram
C3'13771.99383.2677.9111.9271histogram
C42150.3150.6150.4500.212 histogram
C4'10882.30091.3386.2531.868 histogram
C52119.8119.9119.8500.071 histogram
C5'5847.7770.9666.7203.2971histogram
C62157.0157.4157.2000.283 histogram
C8377135.571143.806141.1761.3064histogram
N13223.4227225.2001.800 histogram
N33214.5216.4215.7331.069 histogram
N6977.481.780.2221.285 histogram
N72233.5234.1233.8000.424 histogram
N91170.2170.2170.200 histogram
P439-45.29135.48-2.0734.4236histogram
DCH1'21552.1657.1035.7720.56946histogram
H2'2090-29.456.9342.0651.1168histogram
H2''2064-20.828.4812.3700.8488histogram
H3415.30515.57515.4820.123 histogram
H3'1970-7.378.6154.7390.51617histogram
H3+115.29415.29415.294 histogram
H4'1407-38.5928.544.1531.9544histogram
H411014-0.2612.087.6891.0537histogram
H42988-0.2610.8307.3280.9758histogram
H52144-6.228.2535.4710.73454histogram
H5'661-18.3511.194.1091.5058histogram
H5''569-41.2115.963.9672.8604histogram
H62173-14.728.537.3900.7724histogram
C1'20777.9089.58686.5781.8182histogram
C22158.8159.2159.0000.283 histogram
C2'13030.6269.67240.4363.0372histogram
C3'14166.4180.55476.3402.6042histogram
C42167.8168.0167.9000.141 histogram
C4'9177.8088.44985.2382.2512histogram
C516266.82199.997.7233.3354histogram
C5'4759.3071.7265.9312.583 histogram
C6315133.73148.81142.7551.5194histogram
N11150.7150.7150.700 histogram
N31196.3196.3196.300 histogram
N41795.1100.40598.2821.291 histogram
P669-14.2052.721-1.5205.3317histogram
DGH12734-2.9113.9411.6901.54052histogram
H1'39122.52512.4535.9060.37826histogram
H2'38050.638.232.6480.36158histogram
H2''37610.61211.502.6990.34852histogram
H21553-26.8618.447.6732.47110histogram
H22491-26.8618.446.7782.6202histogram
H3'36950.0013.2394.9500.49513histogram
H4'26450.0013.2634.4130.76121histogram
H5'15620.005.794.1240.27718histogram
H5''13980.006.174.1040.29717histogram
H839256.079.317.7750.27648histogram
C1'29474.991.8284.5292.0065histogram
C22156.5156.7156.6000.141 histogram
C2'19932.44571.79942.5538.25711histogram
C3'20367.7281.40777.3882.4542histogram
C42153.1154.0153.5500.636 histogram
C4'15875.27490.6486.3181.9302histogram
C556116.532119.735117.8040.979 histogram
C5'10858.5071.4266.9461.9341histogram
C62161.0161.4161.2000.283 histogram
C8880116.831142.928138.1112.87011histogram
N188142.411147.7144.9471.763 histogram
N2575.176.175.5200.377 histogram
N74236.9238.3237.2750.685 histogram
N91168.5168.5168.500 histogram
P779-20.91947.102-1.5715.31713histogram
DTH1'23151.6546.8755.8970.47124histogram
H2'22570.5046.2062.1170.43642histogram
H2''22200.784.8742.3720.33643histogram
H38572.12314.5312.9151.73830histogram
H3'21443.7914.114.7810.3903histogram
H4'15121.99514.154.1340.51126histogram
H5'9412.54114.1974.1221.27014histogram
H5''8510.984.613.9620.32019histogram
H623391.619.4277.3530.31914histogram
M721280.187.5251.5940.35510histogram
C1'30280.6092.21886.2831.8323histogram
C22152.9153.4153.1500.354 histogram
C2'22634.3867.58639.9812.1721histogram
C3'22369.43780.177.0152.0371histogram
C42168.5169.1168.8000.424 histogram
C4'11278.889.31385.3812.1301histogram
C51214.30113.630.92038.527 histogram
C5'6159.468.7766.2851.8501histogram
C6491135.016143.6139.0281.2126histogram
C710711.04791.7230015.69012.9743histogram
N11142.9142.9142.900 histogram
N348156.4160.84159.2490.7111histogram
P444-5.6547.785-1.2066.19110histogram