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T79

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OCdoub1.21Å1.21Å
CCAsing1.51Å1.52Å
CE1CD1sing1.47Å1.46Å
CD1CGtrip1.17Å1.21Å
CACBsing1.53Å1.55Å
CANsing1.47Å1.46Å
CGCBsing1.47Å1.46Å
COXTsing1.34Å1.37Å
NHsing1.01Å1.00Å
NH2sing1.01Å1.00Å
CAHAsing1.09Å1.10Å
CBHB3sing1.09Å1.10Å
CBHB2sing1.09Å1.10Å
CE1HE1sing1.09Å1.10Å
CE1HE2sing1.09Å1.10Å
CE1HE3sing1.09Å1.10Å
OXTHXTsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OCCA114.9°120.0°
OCOXT121.7°120.0°
CCACB111.1°109.5°
CCAN109.7°109.5°
CACOXT123.2°119.9°
CCAHA107.1°109.5°
CE1CD1CG176.9°180.0°
CD1CE1HE1109.5°109.5°
CD1CE1HE2109.5°109.4°
CD1CE1HE3109.5°109.5°
CD1CGCB177.9°180.0°
CBCAN114.2°109.4°
CACBCG108.9°109.5°
CBCAHA106.7°109.5°
CACBHB3109.6°109.5°
CACBHB2109.6°109.4°
CANH109.5°111.0°
CANH2109.5°111.0°
NCAHA107.8°109.4°
CGCBHB3109.6°109.5°
CGCBHB2109.6°109.4°
COXTHXT109.5°117.0°
HNH2109.4°111.0°
HB3CBHB2109.5°109.5°
HE1CE1HE2109.5°109.5°
HE1CE1HE3109.4°109.5°
HE2CE1HE3109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OCCAOXT175.8°179.9°
OCCACB95.1°100.0°
OCCAN137.7°20.0°
OCCAHA21.0°140.0°
OCOXTHXT0.0°0.0°
CCACBN124.6°120.0°
CCACBHA116.4°120.1°
CCANHA116.3°120.1°
CCACBCG78.0°175.0°
CCANH180.0°63.9°
CCANH260.0°59.9°
CCACBHB3162.1°64.9°
CCACBHB241.9°55.1°
CACOXTHXT175.5°180.0°
CE1CD1CGCB27.4°100.4°
CD1CE1HE1HE2120.0°120.0°
CD1CE1HE1HE3120.0°120.0°
CD1CE1HE2HE3120.0°120.0°
CD1CGCBCA66.8°50.8°
CD1CGCBHB353.1°69.3°
CD1CGCBHB2173.3°170.7°
CGCD1CE1HE1180.0°28.9°
CGCD1CE1HE260.0°148.9°
CGCD1CE1HE360.0°91.1°
CBCANHA118.3°120.0°
CACBCGHB3119.9°120.1°
CACBCGHB2119.9°119.9°
CBCACOXT89.0°80.1°
CBCANH54.6°176.1°
CBCANH2174.6°60.0°
CACBHB3HB2120.3°119.9°
NCACBCG157.4°65.0°
NCACOXT38.1°160.0°
CANHH2120.0°123.9°
NCACBHB337.5°55.1°
NCACBHB282.7°175.0°
CGCBCAHA38.4°54.9°
CGCBHB3HB2120.3°120.0°
OXTCCAHA154.9°40.0°
HNCAHA63.7°56.1°
H2NCAHA56.3°180.0°
HACACBHB381.5°175.0°
HACACBHB2158.3°65.0°
HE1CE1HE2HE3120.0°120.0°

223532

PDB entries from 2024-08-07

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