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NFQ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CACsing1.51Å1.55Å
O2Cdoub1.21Å1.26Å
CO1sing1.34Å1.25Å
CFNsing1.37Å1.48Å
CANsing1.47Å1.48Å
NHNsing0.97Å1.00Å
O1HO1sing0.97Å0.95Å
CBCAsing1.53Å1.55Å
CAHAsing1.09Å1.10Å
CGCBsing1.51Å1.54Å
CBHBsing1.09Å1.10Å
CBHBAsing1.09Å1.10Å
CFNFdoub1.29Å1.26Å
CFHFsing1.08Å1.08Å
NFHNFsing0.97Å1.00Å
OD1CGdoub1.21Å1.26Å
OD2CGsing1.34Å1.26Å
OD2HOD2sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CACO2119.7°120.0°
CACO1120.7°120.0°
CCAN109.4°109.5°
CCACB109.6°109.5°
CCAHA110.6°109.5°
O2CO1119.4°120.0°
CO1HO1109.5°117.0°
CFNCA120.3°120.0°
CFNHN119.8°120.0°
NCFNF120.9°120.0°
NCFHF119.6°120.0°
CANHN119.9°120.0°
NCACB112.7°109.4°
NCAHA107.4°109.5°
CBCAHA107.1°109.5°
CACBCG115.4°109.5°
CACBHB107.6°109.5°
CACBHBA107.5°109.4°
CGCBHB107.5°109.5°
CGCBHBA107.5°109.5°
CBCGOD1120.0°119.9°
CBCGOD2117.2°120.1°
HBCBHBA111.3°109.5°
NFCFHF119.6°120.0°
CFNFHNF112.0°120.0°
OD1CGOD2122.7°120.0°
CGOD2HOD2109.5°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CACO2O1175.5°179.7°
CCANCF167.2°85.0°
CCANCB122.2°120.0°
CCANHA120.1°120.0°
CCANHN12.8°95.0°
CACO1HO1175.5°179.7°
CCACBHA120.0°120.0°
CCACBCG99.4°175.0°
CCACBHB140.6°65.0°
CCACBHBA20.6°55.0°
O2CCAN178.7°0.3°
O2CO1HO10.0°0.0°
O2CCACB57.3°119.7°
O2CCAHA60.6°120.3°
O1CCAN3.3°180.0°
O1CCACB127.3°60.0°
O1CCAHA114.8°60.0°
CFNCAHN180.0°180.0°
CFNCACB70.6°155.0°
CFNCAHA47.2°35.1°
NCFNFHF180.0°180.0°
NCFNFHNF180.0°180.0°
NCACBHA117.9°120.0°
NCACBCG138.6°65.0°
NCACBHB18.6°55.0°
NCACBHBA101.4°175.0°
CANCFNF167.5°0.0°
CANCFHF12.5°180.0°
HNNCACB109.4°25.0°
HNNCAHA132.9°145.0°
HNNCFNF12.5°180.0°
HNNCFHF167.5°0.0°
CACBCGHB120.0°120.0°
CACBCGHBA120.0°119.9°
CACBHBHBA117.6°119.9°
CACBCGOD144.9°0.0°
CACBCGOD2136.8°180.0°
HACACBCG20.7°54.9°
HACACBHB99.3°175.0°
HACACBHBA140.7°65.0°
CGCBHBHBA117.6°120.0°
CBCGOD1OD2178.3°180.0°
CBCGOD2HOD2178.3°180.0°
HBCBCGOD175.1°120.0°
HBCBCGOD2103.2°60.0°
HBACBCGOD1164.9°120.0°
HBACBCGOD216.8°60.1°
HFCFNFHNF0.0°0.0°
OD1CGOD2HOD20.0°0.1°

218853

PDB entries from 2024-04-24

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