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N12

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1O26doub1.22Å1.23Å
C1C2sing1.50Å1.51Å
C1O27sing1.36Å1.22Å
C2N3sing1.46Å1.47Å
C2H21Asing1.09Å1.10Å
C2H22Asing1.09Å1.10Å
N3C4sing1.44Å1.46Å
N3HN3sing1.03Å1.00Å
C4C5sing1.53Å1.51Å
C4C6sing1.53Å1.55Å
C4H4sing1.10Å1.10Å
C5N14sing1.39Å1.37Å
C5O13doub1.23Å1.22Å
C6C7sing1.53Å1.54Å
C6H61sing1.10Å1.10Å
C6H62sing1.10Å1.10Å
C7C12sing1.53Å1.55Å
C7C8sing1.53Å1.54Å
C7H7sing1.10Å1.10Å
C8C9sing1.53Å1.55Å
C8H81sing1.10Å1.10Å
C8H82sing1.10Å1.10Å
C9C10sing1.53Å1.55Å
C9H91sing1.10Å1.10Å
C9H92sing1.10Å1.10Å
C10C11sing1.53Å1.55Å
C10H101sing1.10Å1.10Å
C10H102sing1.10Å1.10Å
C11C12sing1.53Å1.55Å
C11H111sing1.10Å1.10Å
C11H112sing1.10Å1.10Å
C12H121sing1.10Å1.10Å
C12H122sing1.10Å1.10Å
N14C15sing1.44Å1.49Å
N14HN14sing1.02Å1.00Å
C15C31sing1.53Å1.54Å
C15C16sing1.52Å1.54Å
C15C32sing1.53Å1.54Å
C16O17doub1.23Å1.23Å
C16N18sing1.38Å1.38Å
N18C19sing1.45Å1.49Å
N18HN18sing1.02Å1.00Å
C19C20sing1.50Å1.52Å
C19H191sing1.10Å1.10Å
C19H192sing1.09Å1.10Å
C20C21doub1.38Å1.42ÅAromatic
C20C25sing1.38Å1.41ÅAromatic
C21C22sing1.39Å1.41ÅAromatic
C21H21sing1.09Å1.08Å
C22C23doub1.39Å1.42ÅAromatic
C22H22sing1.08Å1.08Å
C23N24sing1.35Å1.35ÅAromatic
C23C28sing1.45Å1.50Å
N24C25doub1.35Å1.34ÅAromatic
C25H25sing1.09Å1.08Å
O27HO27sing0.98Å0.95Å
C28N30sing1.39Å1.33Å
C28N29doub1.32Å1.33Å
N29HN29sing1.03Å1.00Å
N30H301sing1.01Å1.00Å
N30H302sing1.01Å1.00Å
C31C33sing1.52Å1.55Å
C31H311sing1.10Å1.10Å
C31H312sing1.10Å1.10Å
C32C34sing1.53Å1.55Å
C32H321sing1.10Å1.10Å
C32H322sing1.10Å1.10Å
C33C34sing1.52Å1.55Å
C33H331sing1.10Å1.10Å
C33H332sing1.09Å1.10Å
C34H341sing1.10Å1.10Å
C34H342sing1.09Å1.10Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O26C1C2120.0°126.5°
O26C1O27120.1°123.6°
C2C1O27119.9°110.0°
C1C2N3110.0°108.7°
C1C2H21A109.3°109.6°
C1C2H22A109.2°109.9°
C1O27HO27109.5°111.8°
N3C2H21A109.3°108.9°
N3C2H22A109.2°109.1°
C2N3C4119.2°111.6°
C2N3HN3106.4°108.4°
H21AC2H22A109.9°110.6°
C4N3HN3106.3°110.1°
N3C4C5108.6°107.5°
N3C4C6109.4°112.1°
N3C4H4110.8°106.8°
C5C4C6111.6°110.3°
C5C4H4108.7°109.0°
C4C5N14117.8°112.2°
C4C5O13120.2°123.0°
C6C4H4107.8°110.9°
C4C6C7112.2°112.4°
C4C6H61108.6°110.2°
C4C6H62108.0°110.4°
N14C5O13122.1°124.8°
C5N14C15125.7°122.8°
C5N14HN14117.1°119.4°
C7C6H61108.6°108.2°
C7C6H62108.0°108.8°
C6C7C12110.4°110.7°
C6C7C8109.4°110.7°
C6C7H7108.8°107.5°
H61C6H62111.6°106.7°
C12C7C8109.3°110.8°
C12C7H7108.9°108.5°
C7C12C11109.5°111.7°
C7C12H121109.5°109.8°
C7C12H122109.4°109.8°
C8C7H7110.0°108.5°
C7C8C9110.4°111.7°
C7C8H81109.1°109.8°
C7C8H82109.0°109.8°
C9C8H81109.2°109.2°
C9C8H82108.9°109.3°
C8C9C10110.8°111.7°
C8C9H91109.1°109.6°
C8C9H92108.7°109.4°
H81C8H82110.2°106.8°
C10C9H91109.0°109.7°
C10C9H92108.7°109.4°
C9C10C11110.9°111.6°
C9C10H101109.0°109.7°
C9C10H102108.7°109.4°
H91C9H92110.5°106.9°
C11C10H101109.0°109.7°
C11C10H102108.7°109.4°
C10C11C12110.4°111.7°
C10C11H111109.2°109.5°
C10C11H112109.0°109.7°
H101C10H102110.6°106.9°
C12C11H111109.2°109.4°
C12C11H112109.0°109.6°
C11C12H121109.4°109.3°
C11C12H122109.5°109.3°
H111C11H112110.2°106.9°
H121C12H122109.5°106.8°
C15N14HN14117.1°117.8°
N14C15C31108.7°111.4°
N14C15C16111.9°104.8°
N14C15C32110.0°111.8°
C31C15C16109.4°112.6°
C31C15C32104.2°106.9°
C15C31C33107.2°104.6°
C15C31H311110.3°113.3°
C15C31H312110.7°111.1°
C16C15C32112.4°109.3°
C15C16O17119.0°119.5°
C15C16N18121.3°114.0°
C15C32C34102.9°105.1°
C15C32H321111.7°113.4°
C15C32H322113.1°111.4°
O17C16N18119.8°126.5°
C16N18C19121.5°123.1°
C16N18HN18119.2°118.4°
C19N18HN18119.3°118.5°
N18C19C20113.2°112.0°
N18C19H191108.2°107.9°
N18C19H192107.4°107.8°
C20C19H191108.3°110.7°
C20C19H192107.4°111.1°
C19C20C21120.8°120.6°
C19C20C25120.5°120.6°
H191C19H192112.4°107.3°
C21C20C25118.6°118.9°
C20C21C22119.4°119.2°
C20C21H21120.3°121.0°
C20C25N24120.6°123.5°
C20C25H25119.7°121.7°
C22C21H21120.3°119.7°
C21C22C23118.8°117.9°
C21C22H22120.6°120.4°
C23C22H22120.6°121.7°
C22C23N24119.7°124.0°
C22C23C28120.8°120.3°
N24C23C28119.4°115.7°
C23N24C25122.8°116.4°
C23C28N30121.0°124.5°
C23C28N29120.0°118.0°
N24C25H25119.7°114.8°
N30C28N29119.0°117.5°
C28N30H301108.6°121.6°
C28N30H302125.7°122.2°
C28N29HN29108.7°109.6°
H301N30H302125.7°116.3°
C33C31H311110.2°111.1°
C33C31H312110.8°109.2°
C31C33C34105.6°103.1°
C31C33H331110.8°110.3°
C31C33H332111.6°112.3°
H311C31H312107.7°107.5°
C34C32H321111.7°110.6°
C34C32H322113.1°109.0°
C32C34C33103.2°103.7°
C32C34H341111.6°110.0°
C32C34H342113.0°112.2°
H321C32H322104.5°107.2°
C34C33H331110.8°110.4°
C34C33H332111.6°112.4°
C33C34H341111.6°110.2°
C33C34H342112.9°112.4°
H331C33H332106.5°108.4°
H341C34H342104.8°108.2°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O26C1C2O27179.4°179.9°
O26C1C2N3127.7°1.1°
O26C1C2H21A112.2°120.0°
O26C1C2H22A8.0°118.2°
O26C1O27HO270.0°0.0°
C1C2N3H21A120.0°119.4°
C1C2N3H22A119.8°119.8°
C1C2H21AH22A119.8°121.3°
C1C2N3C4168.3°178.6°
C1C2N3HN348.3°60.0°
C2C1O27HO27179.4°179.9°
O27C1C2N352.9°179.0°
O27C1C2H21A67.1°60.0°
O27C1C2H22A172.7°61.7°
N3C2H21AH22A119.8°119.9°
C2N3C4HN3120.0°120.4°
C2N3C4C574.5°60.4°
C2N3C4C6163.4°178.2°
C2N3C4H444.7°56.5°
H21AC2N3C471.7°59.2°
H21AC2N3HN3168.3°179.4°
H22AC2N3C448.5°61.5°
H22AC2N3HN371.5°59.8°
N3C4C5C6120.7°122.6°
N3C4C5H4120.6°115.4°
N3C4C6H4120.6°119.4°
N3C4C5N14123.4°117.7°
N3C4C5O1356.3°64.6°
N3C4C6C7177.3°59.5°
N3C4C6H6157.3°179.8°
N3C4C6H6263.9°62.2°
HN3N3C4C545.5°60.0°
HN3N3C4C676.5°61.4°
HN3N3C4H4164.8°176.9°
C5C4C6H4119.2°120.8°
C4C5N14O13179.6°177.6°
C5C4C6C757.1°179.3°
C5C4C6H6162.9°60.0°
C5C4C6H62175.9°57.6°
C4C5N14C15179.8°177.6°
C4C5N14HN140.2°0.1°
C6C4C5N14116.0°119.7°
C6C4C5O1364.4°58.0°
C4C6C7H61120.0°121.9°
C4C6C7H62118.9°122.6°
C4C6H61H62118.9°119.9°
C4C6C7C1271.0°174.8°
C4C6C7C8168.7°61.9°
C4C6C7H748.6°56.5°
H4C4C5N142.7°2.3°
H4C4C5O13176.9°180.0°
H4C4C6C762.1°59.9°
H4C4C6H61177.9°60.8°
H4C4C6H6256.7°178.4°
C5N14C15HN14180.0°177.7°
C5N14C15C31171.6°62.1°
C5N14C15C1650.7°60.0°
C5N14C15C3275.0°178.3°
O13C5N14C150.2°0.0°
O13C5N14HN14179.8°177.7°
C7C6H61H62118.9°116.9°
C6C7C12C8120.4°123.2°
C6C7C12H7119.4°117.8°
C6C7C8H7119.4°117.8°
C6C7C8C9179.0°177.8°
C6C7C8H8159.0°56.5°
C6C7C8H8261.4°60.7°
C6C7C12C11178.5°177.8°
C6C7C12H12158.5°60.7°
C6C7C12H12261.5°56.4°
H61C6C7C12169.0°63.3°
H61C6C7C848.7°60.0°
H61C6C7H771.5°178.4°
H62C6C7C1247.9°52.2°
H62C6C7C872.4°175.5°
H62C6C7H7167.4°66.1°
C12C7C8H7119.5°119.0°
C12C7C8C960.0°54.6°
C12C7C8H81180.0°66.8°
C12C7C8H8259.6°176.1°
C7C12C11C1059.3°54.8°
C7C12C11H121120.0°121.7°
C7C12C11H122120.0°121.7°
C7C12C11H111179.3°66.5°
C7C12C11H11260.3°176.5°
C7C12H121H122120.0°119.0°
C7C8C9H81120.0°121.7°
C7C8C9H82119.6°121.8°
C7C8H81H82119.6°119.1°
C7C8C9C1057.0°54.8°
C7C8C9H91177.0°176.5°
C7C8C9H9262.4°66.5°
C8C7C12C1161.1°54.6°
C8C7C12H121178.9°176.1°
C8C7C12H12258.9°66.8°
H7C7C8C959.6°64.4°
H7C7C8H8160.4°174.2°
H7C7C8H82179.2°57.1°
H7C7C12C1159.0°64.4°
H7C7C12H12161.0°57.1°
H7C7C12H122179.0°174.2°
C9C8H81H82119.6°118.1°
C8C9C10H91120.0°121.7°
C8C9C10H92119.4°121.2°
C8C9H91H92119.5°118.5°
C8C9C10C1154.9°54.4°
C8C9C10H10165.1°176.1°
C8C9C10H102174.3°66.8°
H81C8C9C10177.0°66.9°
H81C8C9H9163.0°54.8°
H81C8C9H9257.6°171.8°
H82C8C9C1062.6°176.6°
H82C8C9H9157.4°61.7°
H82C8C9H92178.0°55.3°
C10C9H91H92119.5°118.6°
C9C10C11H101120.0°121.7°
C9C10C11H102119.4°121.2°
C9C10H101H102119.4°118.6°
C9C10C11C1256.3°54.4°
C9C10C11H111176.3°66.9°
C9C10C11H11263.4°176.1°
H91C9C10C11174.9°176.2°
H91C9C10H10154.9°62.1°
H91C9C10H10265.7°54.9°
H92C9C10C1164.6°66.8°
H92C9C10H101175.4°54.9°
H92C9C10H10254.9°171.9°
C11C10H101H102119.4°118.6°
C10C11C12H111120.0°121.3°
C10C11C12H112119.6°121.7°
C10C11H111H112119.6°118.7°
C10C11C12H121179.3°176.5°
C10C11C12H12260.7°66.9°
H101C10C11C1263.7°176.2°
H101C10C11H11156.3°54.9°
H101C10C11H112176.7°62.1°
H102C10C11C12175.7°66.8°
H102C10C11H11164.3°171.9°
H102C10C11H11256.1°54.9°
C12C11H111H112119.6°118.6°
C11C12H121H122120.0°118.1°
H111C11C12H12160.7°55.2°
H111C11C12H12259.3°171.7°
H112C11C12H12159.7°61.7°
H112C11C12H122179.7°54.8°
N14C15C31C16122.4°117.4°
N14C15C31C32117.2°122.5°
N14C15C16C32124.3°120.0°
N14C15C16O1748.0°121.4°
N14C15C16N18132.3°58.7°
N14C15C31C3396.4°139.5°
N14C15C31H311143.6°99.3°
N14C15C31H31224.5°21.9°
N14C15C32C3478.4°114.1°
N14C15C32H321161.6°6.9°
N14C15C32H32244.0°128.0°
HN14N14C15C318.4°120.2°
HN14N14C15C16129.3°117.8°
HN14N14C15C32105.0°0.6°
C31C15C16C32115.2°118.7°
C31C15C16O1772.5°0.1°
C31C15C16N18107.2°180.0°
C15C31C33H311120.0°122.6°
C15C31C33H312120.9°119.0°
C15C31H311H312120.9°123.2°
C31C15C32C3437.9°8.1°
C31C15C32H32182.1°129.1°
C31C15C32H322160.3°109.8°
C15C31C33C344.4°35.8°
C15C31C33H331124.4°82.0°
C15C31C33H332117.1°157.0°
C15C16O17N18179.8°179.8°
C15C16N18C19179.1°179.9°
C15C16N18HN180.9°0.1°
C16C15C31C33141.2°103.0°
C16C15C31H31121.2°18.1°
C16C15C31H31297.9°139.3°
C16C15C32C34156.3°130.3°
C16C15C32H32136.3°108.7°
C16C15C32H32281.3°12.4°
C32C15C16O17172.3°118.6°
C32C15C16N188.0°61.3°
C32C15C31C3320.8°17.1°
C32C15C31H31199.2°138.2°
C32C15C31H312141.7°100.6°
C15C32C34H321120.0°122.8°
C15C32C34H322122.4°119.6°
C15C32H321H322122.7°123.5°
C15C32C34C3340.5°30.3°
C15C32C34H34179.5°87.6°
C15C32C34H342162.8°151.9°
O17C16N18C190.7°0.1°
O17C16N18HN18179.3°180.0°
C16N18C19HN18180.0°180.0°
C16N18C19C2091.4°90.0°
C16N18C19H191148.5°32.1°
C16N18C19H19226.9°147.6°
N18C19C20H191120.0°120.4°
N18C19C20H192118.4°120.5°
N18C19H191H192118.5°115.9°
N18C19C20C2186.6°90.0°
N18C19C20C2595.0°90.0°
HN18N18C19C2088.6°90.0°
HN18N18C19H19131.5°148.0°
HN18N18C19H192153.0°32.4°
C20C19H191H192118.5°121.3°
C19C20C21C25178.5°180.0°
C19C20C21C22179.4°180.0°
C19C20C21H210.6°0.1°
C19C20C25N24179.5°180.0°
C19C20C25H250.5°0.1°
H191C19C20C21153.4°30.4°
H191C19C20C2525.0°149.6°
H192C19C20C2131.8°149.4°
H192C19C20C25146.7°30.6°
C20C21C22H21180.0°179.9°
C20C21C22C231.1°0.0°
C20C21C22H22178.9°180.0°
C21C20C25N241.0°0.0°
C21C20C25H25179.0°179.9°
C25C20C21C221.0°0.0°
C25C20C21H21179.0°179.9°
C20C25N24C231.3°0.1°
C20C25N24H25180.0°179.9°
C21C22C23H22180.0°180.0°
C21C22C23N241.3°0.0°
C21C22C23C28179.6°180.0°
H21C21C22C23178.9°179.9°
H21C21C22H221.1°0.0°
C22C23N24C28179.1°179.9°
C22C23N24C251.4°0.1°
C22C23C28N302.0°0.1°
C22C23C28N29178.4°180.0°
H22C22C23N24178.7°179.9°
H22C22C23C280.4°0.0°
C23N24C25H25178.7°179.8°
N24C23C28N30178.9°180.0°
N24C23C28N290.7°0.1°
C28C23N24C25179.5°180.0°
C23C28N30N29179.7°179.9°
C23C28N29HN290.2°0.1°
C23C28N30H301180.0°179.8°
C23C28N30H3020.0°0.9°
N30C28N29HN29179.8°180.0°
C28N30H301H302180.0°179.4°
N29C28N30H3010.4°0.3°
N29C28N30H302179.7°179.0°
C33C31H311H312120.9°119.4°
C31C33C34C3227.7°41.1°
C31C33C34H331120.0°117.8°
C31C33C34H332121.5°121.1°
C31C33H331H332121.6°123.3°
C31C33C34H34192.3°76.7°
C31C33C34H342150.0°162.5°
H311C31C33C34124.4°158.4°
H311C31C33H331115.6°40.6°
H311C31C33H3322.9°80.4°
H312C31C33C34116.6°83.2°
H312C31C33H3313.5°159.0°
H312C31C33H332122.0°38.0°
C34C32H321H322122.6°118.7°
C32C34C33H341120.0°117.7°
C32C34C33H342122.3°121.5°
C32C34C33H331147.6°76.7°
C32C34C33H33293.8°162.2°
C32C34H341H342122.5°122.9°
H321C32C34C3379.5°153.1°
H321C32C34H341160.5°35.2°
H321C32C34H34242.8°85.3°
H322C32C34C33162.9°89.2°
H322C32C34H34142.9°152.9°
H322C32C34H34274.8°32.4°
C34C33H331H332121.6°123.5°
C33C34H341H342122.5°123.3°
H331C33C34H34127.6°165.5°
H331C33C34H34290.1°44.7°
H332C33C34H341146.2°44.4°
H332C33C34H34228.5°76.3°

222415

PDB entries from 2024-07-10

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