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RT0

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
F35C32sing1.35Å1.35Å
C32C31sing1.39Å1.39ÅAromatic
C32C33doub1.39Å1.40ÅAromatic
C31C30doub1.38Å1.40ÅAromatic
C30C29sing1.39Å1.40ÅAromatic
C33C34sing1.38Å1.40ÅAromatic
C34C29doub1.39Å1.40ÅAromatic
C29C27sing1.48Å1.51Å
C27N26sing1.35Å1.35ÅAromatic
C27C28doub1.36Å1.38ÅAromatic
N26N25doub1.29Å1.41ÅAromatic
N25N24sing1.29Å1.41ÅAromatic
C28N24sing1.35Å1.33ÅAromatic
N24C22sing1.47Å1.49Å
C22C21sing1.54Å1.51Å
C22C23sing1.55Å1.53Å
C21N9sing1.47Å1.48Å
C23C8sing1.55Å1.53Å
C8C6sing1.51Å1.52Å
C8N9sing1.48Å1.47Å
C6O7doub1.21Å1.25Å
C31H31sing1.08Å1.08Å
C33H33sing1.08Å1.08Å
C30H30sing1.08Å1.08Å
C34H34sing1.08Å1.08Å
C28H28sing1.08Å1.08Å
C22H22sing1.09Å1.10Å
C21H211sing1.09Å1.10Å
C21H212sing1.09Å1.10Å
C23H231sing1.09Å1.10Å
C23H232sing1.09Å1.10Å
C8H8sing1.09Å1.10Å
N9H1sing1.01Å1.00Å
C6OXTsing1.34Å1.33Å
OXTHXTsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
F35C32C31119.2°119.9°
F35C32C33120.7°119.9°
C31C32C33120.1°120.2°
C32C31C30119.7°120.1°
C32C31H31120.2°119.9°
C32C33C34120.0°120.1°
C32C33H33120.0°119.9°
C31C30C29120.8°119.9°
C30C31H31120.2°120.0°
C31C30H30119.6°120.0°
C30C29C34119.3°119.8°
C30C29C27119.6°120.1°
C29C30H30119.6°120.1°
C33C34C29120.1°119.9°
C34C33H33120.0°120.0°
C33C34H34120.0°120.1°
C34C29C27121.1°120.1°
C29C34H34119.9°120.0°
C29C27N26117.2°126.9°
C29C27C28131.9°126.9°
N26C27C28110.9°106.2°
C27N26N25107.3°108.8°
C27C28N24105.9°106.1°
C27C28H28127.1°127.0°
N26N25N24104.5°110.5°
N25N24C28111.3°108.4°
N25N24C22116.1°125.8°
C28N24C22132.5°125.8°
N24C28H28127.0°127.0°
N24C22C21105.2°110.7°
N24C22C23114.7°110.7°
N24C22H22110.4°110.6°
C21C22C23106.2°103.0°
C22C21N9101.7°107.2°
C21C22H22110.1°110.7°
C22C21H211111.4°109.9°
C22C21H212111.4°109.9°
C22C23C8103.5°101.6°
C23C22H22109.9°110.9°
C22C23H231110.9°111.0°
C22C23H232110.9°111.0°
C21N9C8112.1°108.6°
N9C21H211111.4°109.9°
N9C21H212111.4°109.9°
C21N9H1108.8°111.0°
C23C8C6112.4°110.3°
C23C8N9105.2°104.8°
C8C23H231111.0°111.0°
C8C23H232111.0°111.0°
C23C8H8109.3°110.3°
C6C8N9110.5°110.4°
C8C6O7120.7°120.0°
C6C8H8109.3°110.4°
C8C6OXT117.9°120.0°
N9C8H8110.0°110.5°
C8N9H1108.8°111.0°
O7C6OXT121.4°120.0°
H211C21H212109.5°110.0°
H231C23H232109.4°110.9°
C6OXTHXT109.5°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
F35C32C31C33179.9°179.7°
F35C32C31C30179.9°180.0°
F35C32C33C34179.9°180.0°
F35C32C31H310.0°0.0°
F35C32C33H330.1°0.0°
C32C31C30H31180.0°180.0°
C32C31C30C290.5°0.1°
C31C32C33C340.2°0.3°
C31C32C33H33179.8°179.7°
C32C31C30H30179.5°179.9°
C33C32C31C300.1°0.3°
C32C33C34H33180.0°180.0°
C32C33C34C290.3°0.0°
C33C32C31H31179.9°179.7°
C32C33C34H34179.7°180.0°
C31C30C29H30180.0°180.0°
C31C30C29C341.0°0.2°
C31C30C29C27179.7°180.0°
C30C29C34C330.9°0.2°
C30C29C34C27178.7°179.8°
C30C29C27N26154.7°0.0°
C30C29C27C2824.1°179.7°
C29C30C31H31179.5°180.0°
C30C29C34H34179.1°179.8°
C33C34C29H34180.0°180.0°
C33C34C29C27179.6°180.0°
C34C29C27N2626.6°179.8°
C34C29C27C28154.5°0.1°
C29C34C33H33179.7°179.9°
C34C29C30H30179.0°179.8°
C29C27N26C28179.1°179.7°
C29C27N26N25179.1°180.0°
C29C27C28N24178.2°179.9°
C27C29C30H300.3°0.0°
C27C29C34H340.4°0.1°
C29C27C28H281.8°0.1°
C27N26N25N240.1°0.0°
N26C27C28N242.9°0.3°
N26C27C28H28177.1°179.8°
C28C27N26N251.9°0.2°
C27C28N24N252.8°0.4°
C27C28N24H28180.0°179.8°
C27C28N24C22179.0°179.8°
N26N25N24C281.7°0.2°
N26N25N24C22178.6°180.0°
N25N24C28C22176.2°179.8°
N25N24C22C21115.6°146.4°
N25N24C22C23128.1°100.0°
N25N24C28H28177.2°179.8°
N25N24C22H223.2°23.3°
C28N24C22C2160.4°33.8°
C28N24C22C2355.9°79.8°
C28N24C22H22179.3°156.9°
N24C22C21C23122.0°118.4°
N24C22C21H22119.0°123.1°
N24C22C23H22125.1°123.2°
N24C22C21N9154.5°140.7°
N24C22C23C8148.2°154.0°
C22N24C28H281.0°0.0°
N24C22C21H21135.8°21.3°
N24C22C21H21286.8°99.9°
N24C22C23H23192.7°87.9°
N24C22C23H23229.1°35.9°
C21C22C23H22119.1°118.5°
C22C21N9H211118.7°119.4°
C22C21N9H212118.7°119.4°
C21C22C23C832.5°35.6°
C22C21N9C821.0°1.0°
C22C21H211H212123.6°121.2°
C21C22C23H231151.5°153.7°
C21C22C23H23286.6°82.4°
C22C21N9H1141.4°121.3°
C23C22C21N932.5°22.3°
C22C23C8H231119.0°118.1°
C22C23C8H232119.0°118.1°
C22C23C8C6139.2°155.9°
C22C23C8N918.9°37.1°
C23C22C21H21186.2°97.1°
C23C22C21H212151.3°141.7°
C22C23H231H232122.7°123.9°
C22C23C8H899.2°81.9°
C21N9C8C231.3°24.1°
C21N9C8C6120.3°142.9°
C21N9C8H1120.4°122.3°
N9C21C22H2286.5°96.3°
N9C21H211H212123.6°121.1°
C21N9C8H8118.9°94.7°
C23C8C6N9117.3°115.4°
C23C8C6H8121.5°122.2°
C23C8N9H8117.6°118.8°
C23C8C6O790.5°100.1°
C8C23C22H2286.7°82.8°
C8C23H231H232122.8°123.9°
C23C8N9H1121.7°98.2°
C23C8C6OXT89.3°80.0°
C6C8N9H8120.8°122.4°
C8C6O7OXT179.8°180.0°
C6C8C23H231101.7°86.0°
C6C8C23H23220.2°37.8°
C6C8N9H10.1°20.6°
C8C6OXTHXT179.8°179.9°
N9C8C6O726.7°15.3°
C8N9C21H21197.7°120.4°
C8N9C21H212139.8°118.5°
N9C8C23H231137.9°155.1°
N9C8C23H232100.2°81.0°
N9C8C6OXT153.4°164.7°
O7C6C8H8148.0°137.7°
O7C6OXTHXT0.0°0.0°
H31C31C30H300.5°0.0°
H33C33C34H340.3°0.0°
H22C22C21H211154.8°144.3°
H22C22C21H21232.3°23.1°
H22C22C23H23132.4°35.3°
H22C22C23H232154.3°159.1°
H211C21N9H122.7°1.9°
H212C21N9H199.8°119.2°
H231C23C8H819.8°36.2°
H232C23C8H8141.7°160.1°
H8C8N9H1120.7°143.0°
H8C8C6OXT32.2°42.2°

223532

PDB entries from 2024-08-07

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