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33X

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OCdoub1.21Å1.22Å
CCAsing1.51Å1.53Å
CMNsing1.47Å1.46Å
CACBsing1.53Å1.52Å
CANsing1.47Å1.48Å
CMHM1sing1.09Å1.10Å
CMHM2sing1.09Å1.10Å
CMHM3sing1.09Å1.10Å
CAHAsing1.09Å1.10Å
CBHB1sing1.09Å1.10Å
CBHB2sing1.09Å1.10Å
CBHB3sing1.09Å1.10Å
NHsing1.01Å1.00Å
COXTsing1.34Å34.47Å
OXTHXTsing0.97Å0.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OCCA119.4°120.0°
OCOXT94.3°120.0°
CCACB110.6°109.4°
CCAN114.5°109.5°
CCAHA106.4°109.5°
CACOXT58.3°120.0°
CMNCA117.1°111.0°
NCMHM1109.5°109.5°
NCMHM2109.5°109.5°
NCMHM3109.5°109.5°
CMNH107.5°111.0°
CBCAN111.4°109.5°
CBCAHA106.5°109.5°
CACBHB1109.5°109.5°
CACBHB2109.5°109.5°
CACBHB3109.5°109.5°
NCAHA107.0°109.5°
CANH107.5°110.9°
HM1CMHM2109.5°109.4°
HM1CMHM3109.4°109.5°
HM2CMHM3109.5°109.4°
HB1CBHB2109.5°109.4°
HB1CBHB3109.5°109.5°
HB2CBHB3109.4°109.5°
COXTHXT90.0°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OCCAOXT75.8°179.9°
OCCACB15.5°120.0°
OCCAN111.4°0.0°
OCCAHA130.7°120.0°
OCOXTHXT90.0°0.0°
CCANCM46.9°155.0°
CCACBN128.5°120.0°
CCACBHA115.2°120.0°
CCANHA117.6°120.0°
CCACBHB1180.0°180.0°
CCACBHB260.0°60.0°
CCACBHB360.0°60.0°
CCANH168.0°31.0°
CACOXTHXT90.0°180.0°
CMNCACB79.6°85.0°
CMNCAH121.1°124.0°
NCMHM1HM2120.0°120.0°
NCMHM1HM3120.0°120.1°
NCMHM2HM3120.0°120.0°
CMNCAHA164.4°35.0°
CBCANHA116.0°120.0°
CACBHB1HB2120.0°120.0°
CACBHB1HB3120.0°120.1°
CACBHB2HB3120.0°120.1°
CBCANH41.6°151.0°
CBCACOXT91.2°60.0°
CANCMHM1180.0°59.9°
CANCMHM260.0°60.0°
CANCMHM360.0°180.0°
NCACBHB151.5°60.0°
NCACBHB2171.5°179.9°
NCACBHB368.5°60.0°
NCACOXT35.6°180.0°
HM1CMHM2HM3120.0°120.0°
HM1CMNH58.9°64.0°
HM2CMNH61.1°176.1°
HM3CMNH178.8°56.1°
HACACBHB164.8°60.0°
HACACBHB255.2°60.0°
HACACBHB3175.1°180.0°
HACANH74.4°89.0°
HACACOXT153.5°59.9°
HB1CBHB2HB3120.0°119.9°

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PDB entries from 2024-09-11

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