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SummaryGeometryRelated PDB entries

JQP

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
F01C02sing1.35Å1.31Å
C03C02doub1.39Å1.41ÅAromatic
C03C04sing1.38Å1.39ÅAromatic
C02C07sing1.39Å1.40ÅAromatic
C04C05doub1.39Å1.41ÅAromatic
C07C06doub1.38Å1.42ÅAromatic
C05C06sing1.39Å1.41ÅAromatic
C05C08sing1.48Å1.41Å
N33C08sing1.34Å1.35ÅAromatic
N33C32doub1.30Å1.36ÅAromatic
C08C09doub1.38Å1.41ÅAromatic
C24C23doub1.38Å1.41ÅAromatic
C24C10sing1.40Å1.41ÅAromatic
C32N25sing1.35Å1.36ÅAromatic
C09C10sing1.47Å1.42Å
C09N25sing1.38Å1.37ÅAromatic
C23N22sing1.32Å1.35ÅAromatic
C10N11doub1.33Å1.37ÅAromatic
N25C26sing1.46Å1.47Å
C27C26sing1.53Å1.55Å
C27C28sing1.53Å1.55Å
N22C12doub1.33Å1.35ÅAromatic
C26C31sing1.53Å1.54Å
N11C12sing1.32Å1.35ÅAromatic
C12N13sing1.39Å1.34Å
C28N29sing1.47Å1.48Å
C31C30sing1.53Å1.55Å
N29C30sing1.47Å1.48Å
N13C14sing1.40Å1.37Å
C14C15doub1.39Å1.40ÅAromatic
C14C21sing1.39Å1.42ÅAromatic
C15C16sing1.38Å1.42ÅAromatic
C21C19doub1.38Å1.41ÅAromatic
C16C17sing1.51Å1.49Å
C16C18doub1.38Å1.42ÅAromatic
C19C18sing1.38Å1.42ÅAromatic
C19C20sing1.51Å1.49Å
C15H151sing1.08Å1.08Å
C17H171sing1.09Å1.10Å
C17H172sing1.09Å1.10Å
C17H173sing1.09Å1.10Å
C20H203sing1.09Å1.10Å
C20H201sing1.09Å1.10Å
C20H202sing1.09Å1.10Å
C21H211sing1.08Å1.08Å
C24H241sing1.08Å1.08Å
C26H261sing1.09Å1.10Å
C28H282sing1.09Å1.10Å
C28H281sing1.09Å1.10Å
C03H031sing1.08Å1.08Å
C04H041sing1.08Å1.08Å
C06H061sing1.08Å1.08Å
C07H071sing1.08Å1.08Å
N13H131sing0.97Å1.00Å
C18H181sing1.08Å1.08Å
C23H231sing1.08Å1.08Å
C27H272sing1.09Å1.10Å
C27H271sing1.09Å1.10Å
N29H1sing1.01Å1.00Å
C30H301sing1.09Å1.10Å
C30H302sing1.09Å1.10Å
C31H312sing1.09Å1.10Å
C31H311sing1.09Å1.10Å
C32H321sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
F01C02C03120.0°119.9°
F01C02C07121.2°119.9°
C02C03C04120.8°120.1°
C03C02C07118.8°120.2°
C02C03H031119.6°120.0°
C03C04C05121.3°119.9°
C04C03H031119.6°120.0°
C03C04H041119.4°120.0°
C02C07C06119.9°120.1°
C02C07H071120.0°120.0°
C04C05C06117.9°119.7°
C04C05C08119.9°120.1°
C05C04H041119.4°120.0°
C07C06C05121.2°119.9°
C07C06H061119.4°120.1°
C06C07H071120.0°119.9°
C06C05C08121.9°120.2°
C05C06H061119.4°120.0°
C05C08N33118.8°126.3°
C05C08C09132.2°126.3°
C08N33C32107.1°109.6°
N33C08C09108.7°107.4°
N33C32N25110.3°109.6°
N33C32H321124.9°125.2°
C08C09C10128.8°127.0°
C08C09N25106.2°106.1°
C23C24C10119.5°118.4°
C24C23N22120.0°119.3°
C23C24H241120.2°120.8°
C24C23H231120.0°120.3°
C24C10C09122.9°120.5°
C24C10N11116.9°118.9°
C10C24H241120.3°120.8°
C32N25C09107.6°107.3°
C32N25C26122.7°126.4°
N25C32H321124.8°125.1°
C10C09N25124.9°126.9°
C09C10N11120.1°120.5°
C09N25C26129.7°126.3°
C23N22C12120.4°121.1°
N22C23H231120.0°120.4°
C10N11C12122.8°120.5°
N25C26C27115.3°109.6°
N25C26C31108.9°109.5°
N25C26H261108.6°109.5°
C26C27C28111.2°109.3°
C27C26C31108.5°109.2°
C27C26H261107.5°109.5°
C26C27H272109.0°109.5°
C26C27H271109.0°109.5°
C27C28N29111.0°109.5°
C27C28H282109.1°109.4°
C27C28H281109.1°109.5°
C28C27H272109.1°109.5°
C28C27H271109.0°109.5°
N22C12N11120.4°121.8°
N22C12N13123.5°119.1°
C26C31C30110.5°109.3°
C31C26H261107.7°109.5°
C26C31H312109.2°109.5°
C26C31H311109.2°109.5°
N11C12N13116.1°119.1°
C12N13C14127.5°120.0°
C12N13H131116.3°120.0°
C28N29C30111.0°111.2°
N29C28H282109.1°109.4°
N29C28H281109.1°109.5°
C28N29H1109.1°111.0°
C31C30N29112.9°109.5°
C31C30H301108.6°109.5°
C31C30H302108.6°109.4°
C30C31H312109.2°109.5°
C30C31H311109.2°109.5°
C30N29H1109.1°111.1°
N29C30H301108.6°109.5°
N29C30H302108.6°109.5°
N13C14C15124.6°120.1°
N13C14C21115.9°120.1°
C14N13H131116.2°120.0°
C15C14C21119.5°119.8°
C14C15C16121.0°120.0°
C14C15H151119.5°120.0°
C14C21C19121.1°119.9°
C14C21H211119.4°120.1°
C15C16C17119.2°120.0°
C15C16C18118.5°120.0°
C16C15H151119.5°120.0°
C21C19C18118.4°120.1°
C21C19C20122.8°119.9°
C19C21H211119.4°120.0°
C17C16C18122.3°120.0°
C16C17H171109.5°109.4°
C16C17H172109.5°109.5°
C16C17H173109.5°109.4°
C16C18C19121.5°120.2°
C16C18H181119.2°119.9°
C18C19C20118.7°120.0°
C19C18H181119.3°119.9°
C19C20H203109.5°109.5°
C19C20H201109.5°109.5°
C19C20H202109.4°109.5°
H171C17H172109.5°109.5°
H171C17H173109.5°109.5°
H172C17H173109.5°109.5°
H203C20H201109.5°109.4°
H203C20H202109.4°109.5°
H201C20H202109.5°109.5°
H282C28H281109.5°109.5°
H272C27H271109.5°109.5°
H301C30H302109.4°109.4°
H312C31H311109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
F01C02C03C07178.8°179.7°
F01C02C03C04179.5°180.0°
F01C02C07C06179.6°179.7°
F01C02C03H0310.4°0.0°
F01C02C07H0710.4°0.0°
C02C03C04H031180.0°180.0°
C02C03C04C052.9°0.0°
C03C02C07C060.8°0.6°
C02C03C04H041177.1°179.9°
C03C02C07H071179.2°179.7°
C04C03C02C071.6°0.3°
C03C04C05H041180.0°179.9°
C03C04C05C063.3°0.0°
C03C04C05C08177.2°180.0°
C02C07C06H071180.0°179.8°
C02C07C06C051.2°0.6°
C07C02C03H031178.4°179.7°
C02C07C06H061178.7°179.7°
C04C05C06C072.4°0.3°
C04C05C06C08173.8°180.0°
C04C05C08N3330.0°35.3°
C04C05C08C09156.1°145.0°
C05C04C03H031177.1°180.0°
C04C05C06H061177.6°180.0°
C07C06C05H061180.0°179.7°
C07C06C05C08176.3°179.7°
C06C05C08N33143.7°144.6°
C06C05C08C0930.1°35.0°
C06C05C04H041176.8°179.9°
C05C06C07H071178.7°179.7°
C05C08N33C09175.2°179.7°
C05C08N33C32176.3°179.8°
C05C08C09C106.6°0.1°
C05C08C09N25175.9°180.0°
C08C05C04H0412.8°0.0°
C08C05C06H0613.7°0.0°
C08N33C32N250.2°0.5°
N33C08C09C10179.1°179.8°
N33C08C09N251.6°0.3°
C08N33C32H321179.7°179.8°
C32N33C08C091.1°0.5°
N33C32N25H321180.0°179.7°
N33C32N25C090.7°0.3°
N33C32N25C26179.6°179.8°
C08C09C10C2432.1°139.4°
C08C09N25C321.4°0.0°
C08C09C10N25177.1°179.9°
C08C09C10N11151.7°40.3°
C08C09N25C26179.0°180.0°
C23C24C10H241180.0°180.0°
C23C24C10C09179.4°179.7°
C24C23N22H231180.0°180.0°
C23C24C10N113.1°0.0°
C24C23N22C123.1°0.0°
C24C10C09N11176.2°179.7°
C24C10C09N25145.0°40.7°
C10C24C23N224.3°0.0°
C24C10N11C120.9°0.0°
C10C24C23H231175.7°180.0°
C32N25C09C10179.0°179.9°
C32N25C09C26179.6°180.0°
C32N25C26C2761.5°54.0°
C32N25C26C3160.7°65.7°
C32N25C26H261177.8°174.1°
C10C09N25C261.4°0.0°
C09C10N11C12177.3°179.7°
C09C10C24H2410.6°0.3°
N25C09C10N1131.2°139.6°
C09N25C26C27118.9°126.0°
C09N25C26C31118.8°114.3°
C09N25C26H2611.8°5.8°
C09N25C32H321179.3°180.0°
C23N22C12N110.9°0.1°
C23N22C12N13179.8°180.0°
N22C23C24H241175.7°180.0°
C10N11C12N220.3°0.1°
C10N11C12N13178.7°180.0°
N11C10C24H241176.9°180.0°
N25C26C27C31122.5°119.9°
N25C26C27H261121.3°120.2°
N25C26C27C28178.3°177.6°
N25C26C31H261117.6°120.1°
N25C26C31C30179.6°177.6°
N25C26C27H27258.0°57.7°
N25C26C27H27161.4°62.5°
N25C26C31H31259.5°62.5°
N25C26C31H31160.2°57.7°
C26N25C32H3210.4°0.0°
C26C27C28H272120.3°119.9°
C26C27C28H271120.3°120.0°
C27C26C31H261116.1°119.9°
C26C27C28N2958.0°59.2°
C27C26C31C3054.2°57.6°
C26C27C28H282178.2°179.1°
C26C27C28H28162.3°60.9°
C26C27H272H271119.2°120.1°
C27C26C31H312174.3°177.6°
C27C26C31H31166.0°62.3°
C28C27C26C3155.8°57.6°
C27C28N29H282120.3°120.0°
C27C28N29H281120.2°120.0°
C27C28N29C3057.4°61.8°
C28C27C26H26160.4°62.3°
C27C28H282H281119.3°120.0°
C28C27H272H271119.2°120.1°
C27C28N29H162.8°62.4°
N22C12N11N13179.0°179.9°
N22C12N13C14174.1°5.6°
N22C12N13H1315.9°174.5°
C12N22C23H231176.9°179.9°
C26C31C30H312120.1°120.0°
C26C31C30H311120.2°119.9°
C26C31C30N2956.2°59.2°
C31C26C27H27264.4°62.3°
C31C26C27H271176.1°177.6°
C26C31C30H30164.4°179.2°
C26C31C30H302176.7°60.9°
C26C31H312H311119.5°120.1°
N11C12N13C146.9°174.3°
N11C12N13H131173.1°5.6°
C12N13C14H131180.0°179.9°
C12N13C14C1550.6°146.7°
C12N13C14C21129.1°33.3°
C28N29C30C3157.2°61.7°
C28N29C30H1120.2°124.1°
N29C28H282H281119.3°120.0°
N29C28C27H27262.3°60.7°
N29C28C27H271178.2°179.2°
C28N29C30H30163.3°178.2°
C28N29C30H302177.7°58.2°
C31C30N29H301120.5°120.1°
C31C30N29H302120.5°120.0°
C30C31C26H26162.0°62.3°
C31C30N29H163.0°62.4°
C31C30H301H302118.4°119.9°
C30C31H312H311119.5°120.1°
C30N29C28H282177.7°178.3°
C30N29C28H28162.8°58.3°
N29C30H301H302118.5°120.0°
N29C30C31H312176.3°179.2°
N29C30C31H31164.0°60.8°
N13C14C15C21179.7°180.0°
N13C14C15C16179.9°180.0°
N13C14C21C19179.7°179.5°
N13C14C15H1510.1°0.3°
N13C14C21H2110.3°0.2°
C14C15C16H151180.0°179.7°
C15C14C21C190.6°0.5°
C14C15C16C17179.5°179.8°
C14C15C16C180.2°0.3°
C15C14C21H211179.4°179.8°
C15C14N13H131129.4°33.4°
C21C14C15C160.4°0.0°
C14C21C19H211180.0°179.3°
C14C21C19C180.6°0.7°
C14C21C19C20179.9°180.0°
C21C14C15H151179.6°179.7°
C21C14N13H13150.8°146.6°
C15C16C17C18179.3°180.0°
C15C16C18C190.2°0.1°
C15C16C17H17189.7°90.0°
C15C16C17H172150.4°150.0°
C15C16C17H17330.3°30.0°
C15C16C18H181179.8°180.0°
C21C19C18C160.4°0.4°
C21C19C18C20179.4°179.3°
C21C19C20H20390.3°90.1°
C21C19C20H201149.6°150.0°
C21C19C20H20229.6°30.0°
C21C19C18H181179.6°179.5°
C17C16C18C19179.5°180.0°
C17C16C15H1510.5°0.0°
C16C17H171H172120.0°120.0°
C16C17H171H173120.0°119.9°
C16C17H172H173120.0°120.0°
C17C16C18H1810.5°0.0°
C16C18C19H181180.0°179.9°
C16C18C19C20179.8°179.7°
C18C16C15H151179.8°180.0°
C18C16C17H17189.6°90.0°
C18C16C17H17230.4°30.1°
C18C16C17H173150.4°150.1°
C18C19C20H20390.3°89.3°
C18C19C20H20129.7°30.7°
C18C19C20H202149.7°150.7°
C18C19C21H211179.4°180.0°
C19C20H203H201120.0°120.0°
C19C20H203H202120.0°120.0°
C19C20H201H202120.0°120.0°
C20C19C21H2110.1°0.7°
C20C19C18H1810.2°0.2°
H171C17H172H173120.0°120.0°
H203C20H201H202120.0°120.0°
H241C24C23H2314.3°0.0°
H261C26C27H272179.3°177.8°
H261C26C27H27159.8°57.7°
H261C26C31H31258.2°57.7°
H261C26C31H311177.8°177.8°
H282C28C27H27258.0°59.2°
H282C28C27H27161.5°60.9°
H282C28N29H157.4°57.6°
H281C28C27H272177.5°179.2°
H281C28C27H27158.0°59.1°
H281C28N29H1177.0°177.6°
H031C03C04H0412.9°0.1°
H061C06C07H0711.3°0.0°
H1N29C30H301176.5°57.7°
H1N29C30H30257.5°177.7°
H301C30C31H31255.8°60.8°
H301C30C31H311175.5°59.3°
H302C30C31H31263.2°59.1°
H302C30C31H31156.5°179.2°

222624

PDB entries from 2024-07-17

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