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41Q

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
ND2CGdoub1.29Å1.30Å
CGCBsing1.51Å1.52Å
CGOD1sing1.35Å1.42Å
CBCAsing1.53Å1.51Å
OCdoub1.21Å1.26Å
CANsing1.47Å1.43Å
CACsing1.51Å1.51Å
COXTsing1.34Å1.32Å
NHsing1.01Å1.00Å
NH2sing1.01Å1.00Å
CAHAsing1.09Å1.10Å
CBHB2sing1.09Å1.10Å
CBHB1sing1.09Å1.10Å
ND2HD21sing0.97Å1.00Å
OD1HD11sing0.97Å0.95Å
OXTHXTsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
ND2CGCB118.5°119.9°
ND2CGOD1118.9°120.0°
CGND2HD21112.0°120.0°
CBCGOD1122.6°120.0°
CGCBCA113.4°109.5°
CGCBHB2108.5°109.5°
CGCBHB1108.5°109.5°
CGOD1HD11109.5°114.0°
CBCAN106.1°109.4°
CBCAC111.9°109.5°
CBCAHA108.3°109.5°
CACBHB2108.5°109.5°
CACBHB1108.5°109.4°
OCCA121.5°120.0°
OCOXT122.6°120.0°
NCAC112.9°109.5°
CANH109.5°111.0°
CANH2109.4°111.0°
NCAHA109.3°109.4°
CACOXT115.9°120.0°
CCAHA108.2°109.5°
COXTHXT109.5°117.0°
HNH2109.5°111.0°
HB2CBHB1109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
ND2CGCBOD1179.7°180.0°
ND2CGCBCA162.1°0.0°
ND2CGCBHB277.3°120.0°
ND2CGCBHB141.5°120.0°
ND2CGOD1HD11180.0°0.0°
CGCBCAHB2120.6°120.1°
CGCBCAHB1120.6°120.0°
CGCBCAN162.4°65.0°
CGCBCAC74.0°175.0°
CGCBCAHA45.2°54.9°
CGCBHB2HB1118.2°120.0°
CBCGND2HD21179.7°180.0°
CBCGOD1HD110.3°180.0°
OD1CGCBCA17.6°180.0°
OD1CGCBHB2103.0°60.0°
OD1CGCBHB1138.2°60.0°
OD1CGND2HD210.0°0.0°
CBCACO15.6°100.1°
CBCANC123.0°120.0°
CBCANHA116.5°120.0°
CBCACHA119.2°120.1°
CBCACOXT162.3°80.1°
CBCANH180.0°176.0°
CBCANH260.0°60.0°
CACBHB2HB1118.2°119.9°
OCCAN104.1°19.9°
OCCAOXT178.0°179.9°
OCCAHA134.8°139.9°
OCOXTHXT0.0°0.1°
NCACHA121.1°120.0°
NCACOXT78.0°160.0°
CANHH2120.0°124.0°
NCACBHB277.0°55.1°
NCACBHB141.8°175.0°
CCANH57.0°64.0°
CCANH263.0°59.9°
CCACBHB246.6°64.9°
CCACBHB1165.4°55.0°
CACOXTHXT177.9°179.9°
OXTCCAHA43.1°40.0°
HNCAHA63.5°56.0°
H2NCAHA176.5°180.0°
HACACBHB2165.8°175.0°
HACACBHB175.4°65.0°

218500

PDB entries from 2024-04-17

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