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SummaryGeometryRelated PDB entries

I08

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
F96C76sing1.35Å1.34Å
C76C75doub1.38Å1.35ÅAromatic
C76C71sing1.40Å1.41ÅAromatic
C75O95sing1.36Å1.40Å
C75C74sing1.39Å1.42ÅAromatic
O95C98sing1.43Å1.44Å
C98H981sing1.09Å1.12Å
C98H982sing1.09Å1.12Å
C98H983sing1.09Å1.12Å
C74C73doub1.38Å1.37ÅAromatic
C74H74sing1.08Å1.10Å
C73C72sing1.39Å1.43ÅAromatic
C73H73sing1.08Å1.10Å
C72O92sing1.36Å1.30Å
C72C71doub1.40Å1.42ÅAromatic
O92H92sing0.97Å0.95Å
C71C61sing1.47Å1.44Å
C61O62doub1.22Å1.22Å
C61C54sing1.48Å1.44Å
C54C55sing1.40Å1.42ÅAromatic
C54C53doub1.40Å1.40ÅAromatic
C55C56doub1.37Å1.40ÅAromatic
C55H55sing1.08Å1.10Å
C56C51sing1.40Å1.41ÅAromatic
C56H56sing1.08Å1.10Å
C53C52sing1.37Å1.40ÅAromatic
C53H53sing1.08Å1.10Å
C52C51doub1.40Å1.45ÅAromatic
C52H52sing1.08Å1.10Å
C51C42sing1.48Å1.45Å
C42C41doub1.33Å1.35Å
C42H42sing1.08Å1.10Å
C41C37sing1.51Å1.50Å
C41H41sing1.08Å1.10Å
C37C36sing1.56Å1.57Å
C37C31sing1.51Å1.55Å
C37H37sing1.09Å1.12Å
C36C35sing1.46Å1.56Å
C36H361sing1.09Å1.11Å
C36H362sing1.09Å1.11Å
C35C34sing1.53Å1.53Å
C35H351sing1.09Å1.12Å
C35H352sing1.09Å1.11Å
C34N33sing1.44Å1.49Å
C34H341sing1.09Å1.12Å
C34H342sing1.09Å1.11Å
N33C32sing1.48Å1.48Å
N33H33sing1.01Å1.02Å
C32C31sing1.54Å1.51Å
C32H321sing1.09Å1.11Å
C32H322sing1.09Å1.11Å
C31N23sing1.47Å1.46Å
C31H31sing1.09Å1.12Å
N23C21sing1.35Å1.39Å
N23H23sing0.97Å1.02Å
C21O22doub1.22Å1.23Å
C21C14sing1.48Å1.45Å
C14C13sing1.40Å1.41ÅAromatic
C14C15doub1.40Å1.42ÅAromatic
C13C12doub1.38Å1.37ÅAromatic
C13H13sing1.08Å1.10Å
C12N11sing1.32Å1.39ÅAromatic
C12H12sing1.08Å1.10Å
N11C16doub1.32Å1.39ÅAromatic
C16C15sing1.38Å1.39ÅAromatic
C16H16sing1.08Å1.10Å
C15H15sing1.08Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
F96C76C75116.8°120.2°
F96C76C71119.0°120.1°
C75C76C71124.1°119.8°
C76C75O95118.8°119.9°
C76C75C74116.6°120.2°
C76C71C72119.6°119.6°
C76C71C61120.5°120.2°
O95C75C74124.6°119.8°
C75O95C98116.0°106.8°
C75C74C73121.8°120.4°
C75C74H74120.8°119.8°
O95C98H981109.9°109.4°
O95C98H982116.0°109.5°
O95C98H983109.8°109.4°
H981C98H982109.9°109.5°
H981C98H983100.3°109.5°
H982C98H983109.9°109.5°
C73C74H74117.4°119.7°
C74C73C72121.6°120.2°
C74C73H73117.2°119.9°
C72C73H73121.2°119.9°
C73C72O92122.2°120.1°
C73C72C71116.3°119.8°
O92C72C71121.5°120.0°
C72O92H92122.1°106.8°
C72C71C61119.8°120.2°
C71C61O62118.4°120.0°
C71C61C54124.5°120.0°
O62C61C54117.1°120.0°
C61C54C55118.7°120.0°
C61C54C53119.9°120.0°
C55C54C53121.4°120.0°
C54C55C56120.5°120.0°
C54C55H55120.6°120.0°
C54C53C52118.4°120.0°
C54C53H53120.9°120.0°
C56C55H55119.0°120.0°
C55C56C51119.0°120.0°
C55C56H56120.1°120.0°
C51C56H56120.8°120.0°
C56C51C52119.9°120.0°
C56C51C42119.7°119.9°
C52C53H53120.7°120.0°
C53C52C51120.8°120.0°
C53C52H52118.1°120.0°
C51C52H52121.2°120.0°
C52C51C42120.4°120.0°
C51C42C41122.4°120.0°
C51C42H42122.5°120.0°
C41C42H42115.1°120.0°
C42C41C37120.9°120.0°
C42C41H41114.5°120.0°
C37C41H41124.6°120.0°
C41C37C36107.0°109.6°
C41C37C31114.0°109.6°
C41C37H37110.6°109.6°
C36C37C31115.8°108.9°
C36C37H37108.6°109.6°
C37C36C35114.7°109.8°
C37C36H361110.3°109.4°
C37C36H362110.3°109.4°
C31C37H37100.6°109.6°
C37C31C32117.2°114.6°
C37C31N23109.9°108.5°
C37C31H31102.5°108.3°
C35C36H361110.3°109.5°
C35C36H362110.3°109.4°
C36C35C34109.2°113.9°
C36C35H351112.3°108.6°
C36C35H352112.3°108.6°
H361C36H362100.0°109.4°
C34C35H351112.3°108.6°
C34C35H352112.3°108.6°
C35C34N33110.3°106.9°
C35C34H341111.9°110.0°
C35C34H342111.9°110.0°
H351C35H35298.1°108.4°
N33C34H341111.9°109.9°
N33C34H342111.9°110.0°
C34N33C32114.6°108.7°
C34N33H33110.3°106.7°
H341C34H34298.5°110.0°
C32N33H33110.3°106.7°
N33C32C31111.7°114.0°
N33C32H321111.4°108.6°
N33C32H322111.4°108.6°
C31C32H321111.4°108.6°
C31C32H322111.4°108.5°
C32C31N23105.7°108.4°
C32C31H31107.0°108.5°
H321C32H32298.9°108.4°
N23C31H31114.7°108.4°
C31N23C21121.5°120.0°
C31N23H23121.9°120.0°
C21N23H23116.5°120.1°
N23C21O22117.0°120.0°
N23C21C14122.6°120.0°
O22C21C14120.3°120.0°
C21C14C13116.9°120.9°
C21C14C15124.4°120.9°
C13C14C15118.7°118.1°
C14C13C12120.9°119.0°
C14C13H13120.8°120.5°
C14C15C16119.9°119.0°
C14C15H15120.9°120.5°
C12C13H13118.3°120.5°
C13C12N11119.9°120.9°
C13C12H12119.4°119.6°
N11C12H12120.8°119.5°
C12N11C16120.9°122.1°
N11C16C15119.7°120.9°
N11C16H16120.0°119.6°
C15C16H16120.3°119.5°
C16C15H15119.2°120.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
F96C76C75C71176.7°179.5°
F96C76C75O950.9°0.3°
F96C76C75C74178.1°180.0°
F96C76C71C72178.9°180.0°
F96C76C71C614.5°0.3°
C76C75O95C74178.9°179.7°
C76C75O95C98169.6°179.7°
C76C75C74C730.7°0.3°
C76C75C74H74179.3°179.7°
C75C76C71C722.3°0.6°
C75C76C71C61178.9°179.8°
C71C76C75O95177.6°179.7°
C71C76C75C741.4°0.6°
C76C71C72C731.0°0.3°
C76C71C72O92177.5°179.7°
C76C71C72C61176.6°179.7°
C76C71C61O6266.1°91.4°
C76C71C61C54115.4°88.6°
C75O95C98H98154.7°60.0°
C75O95C98H982180.0°60.0°
C75O95C98H98354.7°180.0°
O95C75C74C73179.7°180.0°
O95C75C74H740.3°0.0°
C74C75O95C9811.5°0.0°
C75C74C73H74180.0°180.0°
C75C74C73C722.0°0.0°
C75C74C73H73178.0°180.0°
O95C98H981H982128.7°120.0°
O95C98H981H983115.6°119.9°
O95C98H982H983125.2°120.0°
H981C98H982H983109.5°120.0°
C74C73C72H73180.0°180.0°
C74C73C72O92179.6°180.0°
C74C73C72C711.1°0.0°
H74C74C73C72178.0°180.0°
H74C74C73H732.0°0.1°
C73C72O92C71178.4°180.0°
C73C72O92H92180.0°85.0°
C73C72C71C61177.6°180.0°
H73C73C72O920.4°0.1°
H73C73C72C71178.9°179.9°
O92C72C71C610.9°0.0°
C71C72O92H921.6°94.9°
C72C71C61O62110.4°88.3°
C72C71C61C5468.0°91.7°
C71C61O62C54178.6°180.0°
C71C61C54C5516.3°174.8°
C71C61C54C53163.7°4.9°
O62C61C54C55165.2°5.2°
O62C61C54C5314.7°175.1°
C61C54C55C53179.9°179.7°
C61C54C55C56178.5°180.0°
C61C54C55H551.5°0.0°
C61C54C53C52179.1°179.6°
C61C54C53H530.8°0.3°
C54C55C56H55180.0°180.0°
C54C55C56C511.3°0.0°
C54C55C56H56178.7°180.0°
C55C54C53C520.8°0.6°
C55C54C53H53179.2°180.0°
C53C54C55C561.4°0.3°
C53C54C55H55178.6°179.7°
C54C53C52H53180.0°179.3°
C54C53C52C510.1°0.7°
C54C53C52H52179.9°179.7°
C55C56C51H56180.0°180.0°
C55C56C51C520.6°0.0°
C55C56C51C42179.6°180.0°
H55C55C56C51178.7°180.0°
H55C55C56H561.3°0.0°
C56C51C52C530.0°0.3°
C56C51C52C42179.0°180.0°
C56C51C52H52180.0°180.0°
C56C51C42C4111.6°180.0°
C56C51C42H42168.4°0.0°
H56C56C51C52179.4°180.0°
H56C56C51C420.4°0.0°
C53C52C51H52180.0°179.6°
C53C52C51C42179.0°179.6°
H53C53C52C51179.9°180.0°
H53C53C52H520.1°0.4°
C52C51C42C41169.4°0.0°
C52C51C42H4210.6°180.0°
H52C52C51C421.0°0.0°
C51C42C41H42180.0°180.0°
C51C42C41C37177.6°180.0°
C51C42C41H412.4°0.0°
C42C41C37H41180.0°180.0°
C42C41C37C3676.1°120.3°
C42C41C37C31154.5°120.3°
C42C41C37H3742.0°0.0°
H42C42C41C372.4°0.0°
H42C42C41H41177.6°NaN°
C41C37C36C31128.4°119.8°
C41C37C36H37119.4°120.3°
C41C37C31H37118.4°120.3°
C41C37C36C3551.8°167.5°
C41C37C36H361177.1°72.3°
C41C37C36H36273.4°47.5°
C41C37C31C32109.9°149.0°
C41C37C31N23129.4°27.7°
C41C37C31H317.0°89.8°
H41C41C37C36103.9°59.7°
H41C41C37C3125.5°59.7°
H41C41C37H37138.0°180.0°
C36C37C31H37116.8°119.9°
C37C36C35H361125.2°120.1°
C37C36C35H362125.3°120.1°
C37C36H361H362116.1°119.8°
C37C36C35C3482.5°61.2°
C37C36C35H351152.3°177.7°
C37C36C35H35242.8°60.0°
C36C37C31C3214.9°91.2°
C36C37C31N23105.8°147.5°
C36C37C31H31131.8°30.0°
C31C37C36C3576.5°72.6°
C31C37C36H36148.7°47.5°
C31C37C36H362158.2°167.3°
C37C31C32N3354.8°43.2°
C37C31C32N23122.9°121.3°
C37C31C32H31114.4°121.1°
C37C31C32H32170.5°164.4°
C37C31C32H322179.9°77.9°
C37C31N23H31114.9°117.4°
C37C31N23C21112.2°149.9°
C37C31N23H2367.8°30.0°
H37C37C36C35171.2°47.2°
H37C37C36H36163.5°167.4°
H37C37C36H36246.0°72.8°
H37C37C31C32131.7°28.7°
H37C37C31N2311.1°92.6°
H37C37C31H31111.4°149.9°
C35C36H361H362116.2°119.9°
C36C35C34H351125.3°121.1°
C36C35C34H352125.3°121.2°
C36C35H351H352118.2°117.8°
C36C35C34N3365.1°87.8°
C36C35C34H34160.2°31.5°
C36C35C34H342169.6°152.8°
H361C36C35C3442.7°58.9°
H361C36C35H35182.5°62.2°
H361C36C35H352168.0°179.9°
H362C36C35C34152.3°178.8°
H362C36C35H35127.0°57.7°
H362C36C35H35282.5°60.1°
C34C35H351H352118.2°117.9°
C35C34N33H341125.3°119.4°
C35C34N33H342125.3°119.4°
C35C34H341H342117.8°121.3°
C35C34N33C3280.2°98.2°
C35C34N33H33154.5°147.1°
H351C35C34N33169.6°151.1°
H351C35C34H34165.1°89.6°
H351C35C34H34244.4°31.7°
H352C35C34N3360.2°33.3°
H352C35C34H341174.5°152.7°
H352C35C34H34265.1°86.0°
N33C34H341H342117.8°121.2°
C34N33C32H33125.2°114.7°
C34N33C32C3195.3°41.6°
C34N33C32H32129.9°79.6°
C34N33C32H322139.4°162.7°
H341C34N33C3245.0°21.2°
H341C34N33H3380.2°93.5°
H342C34N33C32154.5°142.5°
H342C34N33H3329.2°27.8°
N33C32C31H321125.3°121.2°
N33C32C31H322125.3°121.1°
N33C32H321H322117.3°117.8°
N33C32C31N23177.7°164.5°
N33C32C31H3159.6°77.9°
H33N33C32C31139.4°156.4°
H33N33C32H32195.3°35.1°
H33N33C32H32214.1°82.6°
C31C32H321H322117.3°117.7°
C32C31N23H31117.7°117.6°
C32C31N23C21120.4°85.1°
C32C31N23H2359.6°95.0°
H321C32C31N2352.4°74.2°
H321C32C31H31175.1°43.3°
H322C32C31N2357.1°43.4°
H322C32C31H3165.7°161.0°
C31N23C21H23180.0°179.9°
C31N23C21O2210.4°0.1°
C31N23C21C14166.3°180.0°
H31C31N23C212.7°32.6°
H31C31N23H23177.3°147.4°
N23C21O22C14176.8°180.0°
N23C21C14C13168.2°180.0°
N23C21C14C1511.7°0.2°
H23N23C21O22169.6°180.0°
H23N23C21C1413.7°0.1°
O22C21C14C138.4°0.0°
O22C21C14C15171.7°179.7°
C21C14C13C15179.9°179.7°
C21C14C13C12177.9°180.0°
C21C14C13H132.1°0.0°
C21C14C15C16179.5°179.7°
C21C14C15H150.5°0.3°
C14C13C12H13180.0°179.9°
C14C13C12N112.6°0.0°
C14C13C12H12177.3°180.0°
C13C14C15C160.4°0.6°
C13C14C15H15179.6°180.0°
C15C14C13C122.0°0.3°
C15C14C13H13178.0°179.8°
C14C15C16N110.6°0.6°
C14C15C16H15180.0°179.4°
C14C15C16H16179.4°179.8°
C13C12N11H12180.0°180.0°
C13C12N11C161.6°0.0°
H13C13C12N11177.4°179.9°
H13C13C12H122.7°0.0°
C12N11C16C150.0°0.3°
C12N11C16H16180.0°180.0°
H12C12N11C16178.4°180.0°
N11C16C15H16180.0°179.7°
N11C16C15H15179.4°180.0°
H16C16C15H150.6°0.3°

222415

PDB entries from 2024-07-10

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