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HTN

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OCdoub1.21Å1.24Å
CCAsing1.51Å1.53Å
COXTsing1.34Å1.33Å
CEND2sing1.46Å1.46Å
NCAsing1.47Å1.46Å
CACBsing1.53Å1.53Å
CBOGsing1.43Å1.42Å
CBCGsing1.51Å1.53Å
CGOD1doub1.21Å1.23Å
CGND2sing1.35Å1.33Å
CEHE1sing1.09Å1.10Å
CEHE2sing1.09Å1.10Å
CEHE3sing1.09Å1.10Å
NHsing1.01Å1.00Å
NH2sing1.01Å1.00Å
CAHAsing1.09Å1.10Å
CBHB3sing1.09Å1.10Å
OGHOGsing0.97Å0.95Å
ND2HD22sing0.97Å1.00Å
OXTHXTsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OCCA121.2°120.0°
OCOXT122.9°120.0°
CACOXT115.9°120.0°
CCAN110.9°109.5°
CCACB113.7°109.5°
CCAHA105.1°109.5°
COXTHXT109.5°117.0°
CEND2CG125.4°120.0°
ND2CEHE1109.5°109.4°
ND2CEHE2109.4°109.5°
ND2CEHE3109.5°109.5°
CEND2HD22117.3°120.0°
NCACB108.3°109.5°
CANH109.5°111.0°
CANH2109.5°111.0°
NCAHA110.9°109.5°
CACBOG109.1°109.5°
CACBCG113.8°109.5°
CBCAHA107.9°109.5°
CACBHB3105.7°109.5°
OGCBCG106.0°109.4°
OGCBHB3113.5°109.4°
CBOGHOG109.5°114.0°
CBCGOD1123.1°120.0°
CBCGND2115.3°120.0°
CGCBHB3108.8°109.5°
OD1CGND2121.4°120.0°
CGND2HD22117.3°120.0°
HE1CEHE2109.5°109.4°
HE1CEHE3109.4°109.5°
HE2CEHE3109.5°109.5°
HNH2109.4°111.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OCCAOXT179.5°179.6°
OCCAN89.9°20.0°
OCCACB32.3°100.0°
OCCAHA150.2°139.9°
OCOXTHXT0.0°0.1°
CCANCB125.4°120.0°
CCANHA116.4°120.0°
CCACBHA116.2°120.0°
CCACBOG172.5°60.0°
CCACBCG69.4°180.0°
CCANH42.9°176.1°
CCANH2162.9°60.0°
CCACBHB350.0°60.0°
CACOXTHXT179.5°179.7°
OXTCCAN90.6°159.7°
OXTCCACB147.2°80.3°
OXTCCAHA29.4°39.7°
CEND2CGCB179.4°180.0°
CEND2CGOD14.7°0.0°
CEND2CGHD22180.0°180.0°
ND2CEHE1HE2120.0°120.0°
ND2CEHE1HE3120.0°120.0°
ND2CEHE2HE3120.0°120.1°
NCACBHA120.1°120.0°
NCACBOG48.7°60.0°
NCACBCG166.9°60.0°
CANHH2120.0°123.9°
NCACBHB373.7°180.0°
CACBOGCG122.9°120.1°
CACBOGHB3117.6°120.0°
CACBCGHB3117.6°120.0°
CACBCGOD127.0°115.0°
CACBCGND2147.5°64.9°
CBCANH168.3°63.9°
CBCANH271.8°60.0°
CACBOGHOG136.3°60.0°
OGCBCGHB3122.5°119.9°
OGCBCGOD1146.9°5.0°
OGCBCGND227.6°175.0°
OGCBCAHA71.4°180.0°
CBCGOD1ND2174.2°179.9°
CGCBCAHA46.8°60.0°
CGCBOGHOG100.8°60.1°
CBCGND2HD220.6°0.1°
OD1CGCBHB390.6°125.0°
OD1CGND2HD22175.3°180.0°
CGND2CEHE1168.7°60.0°
CGND2CEHE271.3°60.0°
CGND2CEHE348.8°180.0°
ND2CGCBHB394.9°55.1°
HE1CEHE2HE3120.0°120.0°
HE1CEND2HD2211.3°120.0°
HE2CEND2HD22108.7°120.0°
HE3CEND2HD22131.3°0.0°
HNCAHA73.5°56.1°
H2NCAHA46.5°179.9°
HACACBHB3166.2°60.0°
HB3CBOGHOG18.7°180.0°

226262

PDB entries from 2024-10-16

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