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HZJ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O27S25doub1.42Å1.53Å
C23C17sing1.53Å1.51Å
O24S25sing1.52Å1.67Å
O24C22sing1.43Å1.40Å
S25O26doub1.42Å1.54Å
S25N28sing1.66Å1.74Å
C17C22sing1.55Å1.50Å
C17C16sing1.54Å1.51Å
C17C18sing1.53Å1.54Å
C22C21sing1.54Å1.56Å
C16C13sing1.50Å1.53Å
C16C20sing1.54Å1.51Å
C18C19sing1.53Å1.51Å
C19C14sing1.51Å1.49Å
C21C20sing1.54Å1.57Å
C13C14doub1.36Å1.41ÅAromatic
C13C15sing1.40Å1.48ÅAromatic
C14C05sing1.41Å1.47ÅAromatic
C15C12doub1.36Å1.44ÅAromatic
C05C06doub1.41Å1.37ÅAromatic
C05C04sing1.42Å1.41ÅAromatic
C12C04sing1.41Å1.47ÅAromatic
C06C01sing1.36Å1.39ÅAromatic
C04C03doub1.40Å1.37ÅAromatic
C01C02doub1.40Å1.40ÅAromatic
C03C02sing1.37Å1.39ÅAromatic
C02O07sing1.36Å1.39Å
O07S08sing1.52Å1.62Å
S08O10doub1.42Å1.50Å
S08N11sing1.66Å1.69Å
S08O09doub1.42Å1.50Å
C15H1sing1.08Å1.08Å
C20H2sing1.09Å1.10Å
C20H3sing1.09Å1.10Å
C21H4sing1.09Å1.10Å
C21H5sing1.09Å1.10Å
C22H6sing1.09Å1.10Å
C01H7sing1.08Å1.08Å
C03H8sing1.08Å1.08Å
C06H9sing1.08Å1.08Å
C12H10sing1.08Å1.08Å
C16H11sing1.09Å1.10Å
C18H12sing1.09Å1.10Å
C18H13sing1.09Å1.10Å
C19H14sing1.09Å1.10Å
C19H15sing1.09Å1.10Å
C23H16sing1.09Å1.10Å
C23H17sing1.09Å1.10Å
C23H18sing1.09Å1.10Å
N11H19sing0.97Å1.00Å
N11H20sing0.97Å1.00Å
N28H21sing0.97Å1.00Å
N28H22sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O27S25O24108.7°106.4°
O27S25O26104.9°123.2°
O27S25N28113.3°106.4°
C23C17C22114.3°111.4°
C23C17C16106.6°111.4°
C23C17C18108.0°111.7°
C17C23H16109.5°109.5°
C17C23H17109.5°109.5°
C17C23H18109.5°109.5°
S25O24C22109.5°114.0°
O24S25O26109.3°106.4°
O24S25N28109.3°107.2°
O24C22C17106.7°110.0°
O24C22C21112.0°110.0°
O24C22H6111.8°110.0°
O26S25N28111.2°106.4°
S25N28H21109.5°120.0°
S25N28H22109.4°120.0°
C22C17C16102.6°104.2°
C22C17C18112.7°108.2°
C17C22C21106.5°106.6°
C17C22H6110.2°110.1°
C16C17C18112.4°109.6°
C17C16C13122.7°113.1°
C17C16C20113.6°103.7°
C17C16H11104.5°109.8°
C17C18C19115.7°109.2°
C17C18H12107.9°109.5°
C17C18H13107.9°109.6°
C22C21C20105.1°106.6°
C22C21H4110.6°110.1°
C22C21H5110.6°110.1°
C21C22H6109.5°110.0°
C13C16C20105.4°110.3°
C16C13C14116.2°123.2°
C16C13C15123.0°117.0°
C13C16H11104.4°109.7°
C16C20C2195.9°104.1°
C16C20H2112.7°110.5°
C16C20H3112.7°110.5°
C20C16H11104.5°110.0°
C18C19C14117.0°110.0°
C19C18H12107.9°109.5°
C19C18H13107.9°109.4°
C18C19H14107.6°109.4°
C18C19H15107.5°109.4°
C19C14C13124.1°122.2°
C19C14C05115.7°117.9°
C14C19H14107.6°109.6°
C14C19H15107.6°109.2°
C21C20H2112.8°110.5°
C21C20H3112.8°110.6°
C20C21H4110.6°110.0°
C20C21H5110.5°110.0°
C14C13C15120.3°119.9°
C13C14C05120.1°119.9°
C13C15C12118.7°121.9°
C13C15H1120.6°119.1°
C14C05C06116.3°120.7°
C14C05C04120.3°119.9°
C15C12C04120.3°119.6°
C12C15H1120.6°119.0°
C15C12H10119.9°120.2°
C06C05C04123.4°119.4°
C05C06C01116.8°119.6°
C05C06H9121.6°120.2°
C05C04C12120.1°118.9°
C05C04C03119.7°119.6°
C12C04C03120.2°121.5°
C04C12H10119.8°120.2°
C06C01C02120.1°121.0°
C06C01H7119.9°119.4°
C01C06H9121.6°120.2°
C04C03C02117.3°119.5°
C04C03H8121.4°120.2°
C01C02C03122.6°120.9°
C01C02O07115.7°119.6°
C02C01H7119.9°119.5°
C03C02O07121.6°119.6°
C02C03H8121.3°120.3°
C02O07S08125.7°114.0°
O07S08O10111.0°106.4°
O07S08N11109.4°107.3°
O07S08O09106.2°106.4°
O10S08N11113.1°106.4°
O10S08O09107.2°123.2°
N11S08O09109.6°106.4°
S08N11H19109.5°120.0°
S08N11H20109.5°120.0°
H2C20H3109.4°110.5°
H4C21H5109.5°110.0°
H12C18H13109.4°109.7°
H14C19H15109.5°109.3°
H16C23H17109.5°109.5°
H16C23H18109.5°109.5°
H17C23H18109.5°109.5°
H19N11H20109.4°120.0°
H21N28H22109.5°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O27S25O24O26114.0°132.9°
O27S25O24N28124.2°113.6°
O27S25O24C22172.4°171.5°
O27S25O26N28122.9°123.0°
O27S25N28H21180.0°113.5°
O27S25N28H2260.0°66.5°
C23C17C22O2413.6°23.8°
C23C17C22C16115.0°120.3°
C23C17C22C18123.8°123.2°
C23C17C16C18118.2°124.2°
C23C17C22C21106.2°143.0°
C23C17C16C1392.6°83.2°
C23C17C16C20138.7°157.2°
C23C17C18C1977.3°58.9°
C23C17C22H6135.2°97.7°
C23C17C16H1125.4°39.7°
C23C17C18H1243.7°61.0°
C23C17C18H13161.8°178.7°
C17C23H16H17120.0°120.0°
C17C23H16H18120.0°120.0°
C17C23H17H18120.0°120.0°
O24S25O26N28120.7°114.1°
S25O24C22C17139.8°145.0°
S25O24C22C21104.0°97.8°
S25O24C22H619.3°23.5°
O24S25N28H2158.6°0.0°
O24S25N28H2261.4°180.0°
C22O24S25O2673.6°38.5°
C22O24S25N2848.3°75.0°
O24C22C17C21119.8°119.3°
O24C22C17H6121.6°121.4°
O24C22C17C16128.6°96.5°
O24C22C17C18110.3°146.9°
O24C22C21H6124.6°121.4°
O24C22C21C20147.5°119.5°
O24C22C21H493.2°0.2°
O24C22C21H528.3°121.2°
O26S25N28H2162.1°113.5°
O26S25N28H22177.8°66.5°
S25N28H21H22120.0°180.0°
C22C17C16C18121.3°115.6°
C17C22C21H6119.1°119.3°
C22C17C16C13146.9°156.5°
C22C17C16C2018.2°37.0°
C22C17C18C19155.5°178.1°
C17C22C21C2031.2°0.2°
C17C22C21H4150.5°119.1°
C17C22C21H588.0°119.5°
C22C17C16H1195.1°80.6°
C22C17C18H1283.6°62.0°
C22C17C18H1334.6°58.3°
C22C17C23H16180.0°61.5°
C22C17C23H1760.0°178.5°
C22C17C23H1860.0°58.6°
C16C17C22C218.8°22.8°
C17C16C13C20132.1°115.7°
C17C16C13H11118.1°123.0°
C17C16C20H11113.3°117.4°
C16C17C18C1940.1°65.0°
C17C16C20C2135.7°37.1°
C17C16C13C142.8°9.3°
C17C16C13C15169.0°170.9°
C17C16C20H2153.5°81.5°
C17C16C20H382.0°155.9°
C16C17C22H6109.8°142.0°
C16C17C18H12161.0°175.0°
C16C17C18H1380.8°54.7°
C16C17C23H1667.4°177.4°
C16C17C23H1752.7°62.6°
C16C17C23H18172.7°57.4°
C18C17C22C21130.0°93.8°
C18C17C16C1325.6°40.9°
C18C17C16C20103.1°78.6°
C17C18C19H12120.9°119.9°
C17C18C19H13120.9°119.9°
C17C18C19C1433.5°55.1°
C18C17C22H611.3°25.5°
C18C17C16H11143.6°163.9°
C17C18H12H13117.2°120.3°
C17C18C19H1487.6°175.4°
C17C18C19H15154.6°64.9°
C18C17C23H1653.7°59.7°
C18C17C23H17173.7°60.3°
C18C17C23H1866.3°179.7°
C22C21C20C1638.5°22.9°
C22C21C20H4119.3°119.3°
C22C21C20H5119.3°119.3°
C22C21C20H2156.2°95.7°
C22C21C20H379.2°141.6°
C22C21H4H5122.0°121.5°
C13C16C20H11109.7°121.2°
C16C13C14C196.0°0.4°
C13C16C20C21172.7°158.5°
C16C13C14C15172.1°179.7°
C16C13C14C05175.5°179.6°
C16C13C15C12174.7°179.6°
C16C13C15H15.3°0.3°
C13C16C20H269.5°39.8°
C13C16C20H355.0°82.7°
C16C20C21H2117.7°118.6°
C16C20C21H3117.7°118.7°
C20C16C13C14129.2°106.3°
C20C16C13C1558.9°73.4°
C16C20H2H3126.3°122.6°
C16C20C21H4157.8°96.4°
C16C20C21H580.8°142.2°
C18C19C14H14121.1°120.2°
C18C19C14H15121.1°120.0°
C18C19C14C139.7°23.5°
C18C19C14C05168.8°156.5°
C19C18H12H13117.1°120.0°
C18C19H14H15116.6°119.7°
C19C14C13C05178.5°180.0°
C19C14C13C15178.0°179.9°
C19C14C05C060.0°0.1°
C19C14C05C04179.0°179.9°
C14C19C18H12154.5°175.0°
C14C19C18H1387.4°64.8°
C14C19H14H15116.6°119.7°
C21C20H2H3126.4°122.8°
C20C21H4H5122.0°121.3°
C20C21C22H687.9°119.1°
C21C20C16H1177.6°80.3°
C14C13C15C123.2°0.1°
C13C14C05C06178.6°179.9°
C13C14C05C042.4°0.1°
C14C13C15H1176.8°180.0°
C14C13C16H11120.9°132.4°
C13C14C19H14111.4°143.8°
C13C14C19H15130.8°96.5°
C15C13C14C053.5°0.1°
C13C15C12H1180.0°180.0°
C13C15C12C041.8°0.0°
C13C15C12H10178.2°179.9°
C15C13C16H1150.9°47.9°
C14C05C06C04179.0°180.0°
C14C05C04C121.0°0.0°
C14C05C06C01179.5°180.0°
C14C05C04C03179.4°179.9°
C14C05C06H90.4°0.1°
C05C14C19H1470.0°36.2°
C05C14C19H1547.8°83.5°
C15C12C04C050.7°0.1°
C15C12C04H10180.0°180.0°
C15C12C04C03179.6°180.0°
C06C05C04C12180.0°180.0°
C05C06C01H9180.0°179.9°
C06C05C04C030.4°0.0°
C05C06C01C020.1°0.1°
C05C06C01H7179.9°179.9°
C05C04C12C03179.6°180.0°
C04C05C06C010.5°0.1°
C05C04C03C020.3°0.1°
C05C04C03H8179.7°180.0°
C04C05C06H9179.5°180.0°
C05C04C12H10179.3°179.9°
C12C04C03C02179.3°180.0°
C04C12C15H1178.2°179.9°
C12C04C03H80.7°0.1°
C06C01C02H7180.0°180.0°
C06C01C02C030.8°0.0°
C06C01C02O07177.9°179.9°
C04C03C02C010.9°0.1°
C04C03C02H8180.0°179.9°
C04C03C02O07177.9°180.0°
C03C04C12H100.4°0.0°
C01C02C03O07177.0°179.9°
C01C02O07S08120.9°90.0°
C01C02C03H8179.1°180.0°
C02C01C06H9180.0°180.0°
C03C02O07S0861.9°90.0°
C03C02C01H7179.2°180.0°
C02O07S08O1067.0°171.5°
C02O07S08N11167.5°75.0°
C02O07S08O0949.2°38.6°
O07C02C01H72.0°0.1°
O07C02C03H82.1°0.1°
O07S08O10N11123.4°114.1°
O07S08O10O09115.6°122.9°
O07S08N11O09116.1°113.6°
O07S08N11H19180.0°0.1°
O07S08N11H2060.0°180.0°
O10S08N11O09119.6°132.9°
O10S08N11H1955.7°113.6°
O10S08N11H2064.3°66.5°
S08N11H19H20120.0°179.9°
O09S08N11H1963.9°113.5°
O09S08N11H20176.1°66.4°
H1C15C12H101.8°0.1°
H2C20C21H484.5°145.0°
H2C20C21H536.9°23.6°
H2C20C16H1140.2°161.0°
H3C20C21H440.1°22.3°
H3C20C21H5161.5°99.0°
H3C20C16H11164.7°38.5°
H4C21C22H631.4°121.6°
H5C21C22H6152.8°0.1°
H7C01C06H90.1°0.0°
H12C18C19H1433.4°64.6°
H12C18C19H1584.5°55.0°
H13C18C19H14151.5°55.6°
H13C18C19H1533.7°175.3°
H16C23H17H18120.0°120.0°

221716

PDB entries from 2024-06-26

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