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2R5

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C31C32sing1.41Å1.38ÅAromatic
C31C30doub1.35Å1.44ÅAromatic
C17C15sing1.53Å1.53Å
C32C33doub1.35Å1.44ÅAromatic
C30N29sing1.36Å1.33ÅAromatic
C33N29sing1.36Å1.34ÅAromatic
C15C16sing1.53Å1.52Å
C15C18sing1.53Å1.56Å
C15N14sing1.47Å1.50Å
N29C28sing1.47Å1.45Å
O12S11doub1.42Å1.43Å
N14S11sing1.66Å1.70Å
C28C27sing1.53Å1.57Å
S11O13doub1.42Å1.43Å
S11C09sing1.76Å1.78Å
C27O26sing1.43Å1.39Å
C09C08doub1.38Å1.39ÅAromatic
C09C10sing1.38Å1.42ÅAromatic
C08C07sing1.38Å1.42ÅAromatic
O26C25sing1.36Å1.44Å
C25C34doub1.39Å1.41ÅAromatic
C25C24sing1.39Å1.39ÅAromatic
C10C05doub1.39Å1.41ÅAromatic
C07C06doub1.38Å1.40ÅAromatic
C34C35sing1.38Å1.38ÅAromatic
C24C23doub1.38Å1.40ÅAromatic
C35C22doub1.39Å1.40ÅAromatic
C23C22sing1.39Å1.39ÅAromatic
C05C06sing1.39Å1.40ÅAromatic
C05N04sing1.40Å1.43Å
C22N21sing1.40Å1.45Å
N04C03sing1.39Å1.39Å
N19C03doub1.33Å1.31ÅAromatic
N19C20sing1.33Å1.37ÅAromatic
N21C20sing1.39Å1.40Å
C03C02sing1.40Å1.42ÅAromatic
C20N36doub1.32Å1.32ÅAromatic
N36C37sing1.33Å1.33ÅAromatic
C02C37doub1.38Å1.43ÅAromatic
C02C01sing1.51Å1.50Å
C01H1sing1.09Å1.10Å
C01H2sing1.09Å1.10Å
C01H3sing1.09Å1.10Å
N04H4sing0.97Å1.00Å
C06H5sing1.08Å1.08Å
C07H6sing1.08Å1.08Å
C08H7sing1.08Å1.08Å
C10H8sing1.08Å1.08Å
N14H9sing0.97Å1.00Å
C16H10sing1.09Å1.10Å
C16H11sing1.09Å1.10Å
C16H12sing1.09Å1.10Å
C17H13sing1.09Å1.10Å
C17H14sing1.09Å1.10Å
C17H15sing1.09Å1.10Å
C18H16sing1.09Å1.10Å
C18H17sing1.09Å1.10Å
C18H18sing1.09Å1.10Å
N21H19sing0.97Å1.00Å
C23H20sing1.08Å1.08Å
C24H21sing1.08Å1.08Å
C27H22sing1.09Å1.10Å
C27H23sing1.09Å1.10Å
C28H24sing1.09Å1.10Å
C28H25sing1.09Å1.10Å
C30H26sing1.08Å1.08Å
C31H27sing1.08Å1.08Å
C32H28sing1.08Å1.08Å
C33H29sing1.08Å1.08Å
C34H30sing1.08Å1.08Å
C35H31sing1.08Å1.08Å
C37H32sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C32C31C30105.9°107.4°
C31C32C33105.9°107.4°
C32C31H27127.0°126.3°
C31C32H28127.1°126.3°
C31C30N29109.9°108.2°
C31C30H26125.1°125.8°
C30C31H27127.1°126.3°
C17C15C16108.1°109.5°
C17C15C18111.9°109.5°
C17C15N14109.7°109.5°
C15C17H13109.5°109.5°
C15C17H14109.5°109.5°
C15C17H15109.5°109.4°
C32C33N29109.4°108.2°
C33C32H28127.0°126.2°
C32C33H29125.3°125.9°
C30N29C33108.9°108.7°
C30N29C28123.1°125.6°
N29C30H26125.1°125.9°
C33N29C28127.8°125.7°
N29C33H29125.3°125.9°
C16C15C18107.5°109.5°
C16C15N14108.1°109.4°
C15C16H10109.5°109.5°
C15C16H11109.5°109.5°
C15C16H12109.5°109.5°
C18C15N14111.4°109.5°
C15C18H16109.5°109.5°
C15C18H17109.5°109.4°
C15C18H18109.5°109.5°
C15N14S11121.9°120.0°
C15N14H9106.3°120.0°
N29C28C27111.9°109.5°
N29C28H24108.9°109.5°
N29C28H25108.9°109.4°
O12S11N14110.9°106.4°
O12S11O13115.8°123.1°
O12S11C09108.3°106.4°
N14S11O13106.2°106.4°
N14S11C09108.9°107.2°
S11N14H9106.3°120.0°
C28C27O26100.1°109.5°
C28C27H22111.8°109.5°
C28C27H23111.8°109.5°
C27C28H24108.8°109.5°
C27C28H25108.9°109.5°
O13S11C09106.5°106.4°
S11C09C08117.9°120.0°
S11C09C10118.3°120.0°
C27O26C25119.0°117.0°
O26C27H22111.8°109.5°
O26C27H23111.7°109.4°
C08C09C10123.7°120.1°
C09C08C07118.6°120.2°
C09C08H7120.7°119.9°
C09C10C05116.4°119.9°
C09C10H8121.8°120.0°
C08C07C06118.8°120.0°
C08C07H6120.6°120.0°
C07C08H7120.7°119.9°
O26C25C34122.9°120.0°
O26C25C24116.5°119.9°
C34C25C24120.5°120.1°
C25C34C35119.5°120.0°
C25C34H30120.2°120.0°
C25C24C23120.5°120.0°
C25C24H21119.7°120.0°
C10C05C06120.9°119.9°
C10C05N04124.7°120.1°
C05C10H8121.8°120.1°
C07C06C05121.6°119.9°
C07C06H5119.2°120.0°
C06C07H6120.6°119.9°
C34C35C22119.6°120.0°
C35C34H30120.2°120.0°
C34C35H31120.2°120.0°
C24C23C22118.2°120.0°
C24C23H20120.9°120.0°
C23C24H21119.8°120.0°
C35C22C23121.7°120.0°
C35C22N21114.2°120.0°
C22C35H31120.2°120.0°
C23C22N21124.1°120.0°
C22C23H20120.9°120.0°
C06C05N04114.3°120.1°
C05C06H5119.2°120.0°
C05N04C03127.3°120.0°
C05N04H4116.4°120.1°
C22N21C20129.8°120.0°
C22N21H19115.1°120.0°
N04C03N19121.7°120.5°
N04C03C02116.3°120.5°
C03N04H4116.3°119.9°
C03N19C20119.1°120.6°
N19C03C02122.0°119.0°
N19C20N21121.0°119.2°
N19C20N36122.7°121.7°
N21C20N36116.2°119.2°
C20N21H19115.1°120.0°
C03C02C37114.9°118.5°
C03C02C01124.4°120.8°
C20N36C37119.7°120.9°
N36C37C02121.5°119.3°
N36C37H32119.3°120.4°
C37C02C01120.7°120.7°
C02C37H32119.3°120.4°
C02C01H1109.5°109.4°
C02C01H2109.4°109.4°
C02C01H3109.5°109.5°
H1C01H2109.5°109.5°
H1C01H3109.5°109.5°
H2C01H3109.5°109.5°
H10C16H11109.5°109.4°
H10C16H12109.4°109.5°
H11C16H12109.5°109.5°
H13C17H14109.5°109.4°
H13C17H15109.4°109.5°
H14C17H15109.5°109.5°
H16C18H17109.5°109.5°
H16C18H18109.5°109.5°
H17C18H18109.5°109.5°
H22C27H23109.5°109.4°
H24C28H25109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C32C31C30H27180.0°179.8°
C31C32C33H28180.0°179.7°
C32C31C30N290.3°0.0°
C31C32C33N292.6°0.5°
C32C31C30H26179.6°180.0°
C31C32C33H29177.4°180.0°
C30C31C32C331.7°0.3°
C31C30N29H26180.0°180.0°
C31C30N29C331.3°0.3°
C31C30N29C28176.0°180.0°
C30C31C32H28178.3°180.0°
C17C15C16C18121.0°120.0°
C17C15C16N14118.7°120.0°
C17C15C18N14123.2°120.0°
C17C15N14S1173.9°173.4°
C17C15N14H947.9°6.6°
C17C15C16H10180.0°170.3°
C17C15C16H1160.0°69.8°
C17C15C16H1260.0°50.3°
C15C17H13H14120.0°120.0°
C15C17H13H15120.0°120.0°
C15C17H14H15120.0°120.0°
C17C15C18H16180.0°51.5°
C17C15C18H1760.0°68.5°
C17C15C18H1860.0°171.6°
C32C33N29C302.4°0.5°
C32C33N29H29180.0°179.6°
C32C33N29C28176.8°179.8°
C33C32C31H27178.3°179.9°
C30N29C33C28174.4°179.8°
C30N29C28C27165.5°90.0°
C30N29C28H2474.2°30.0°
C30N29C28H2545.2°150.0°
N29C30C31H27179.6°179.8°
C30N29C33H29177.6°180.0°
C33N29C28C278.1°90.3°
C33N29C28H24112.2°149.7°
C33N29C28H25128.5°29.7°
C33N29C30H26178.7°179.8°
N29C33C32H28177.4°179.9°
C16C15C18N14118.2°120.0°
C16C15N14S11168.5°53.4°
C16C15N14H969.8°126.6°
C15C16H10H11120.0°120.0°
C15C16H10H12120.0°120.0°
C15C16H11H12120.0°120.0°
C16C15C17H13180.0°60.0°
C16C15C17H1460.0°180.0°
C16C15C17H1560.0°60.0°
C16C15C18H1661.4°68.5°
C16C15C18H1758.6°171.5°
C16C15C18H18178.6°51.6°
C18C15N14S1150.6°66.6°
C18C15N14H9172.3°113.4°
C18C15C16H1059.0°50.3°
C18C15C16H11179.0°170.2°
C18C15C16H1261.0°69.7°
C18C15C17H1361.8°180.0°
C18C15C17H1458.3°60.0°
C18C15C17H15178.2°60.0°
C15C18H16H17120.0°119.9°
C15C18H16H18120.0°120.0°
C15C18H17H18120.0°120.0°
C15N14S11O1228.0°179.6°
C15N14S11H9121.7°180.0°
C15N14S11O13154.6°47.5°
C15N14S11C0991.0°66.0°
N14C15C16H1061.3°69.7°
N14C15C16H1158.7°50.2°
N14C15C16H12178.7°170.3°
N14C15C17H1362.4°60.0°
N14C15C17H14177.6°60.0°
N14C15C17H1557.6°180.0°
N14C15C18H1656.8°171.6°
N14C15C18H17176.8°51.6°
N14C15C18H1863.2°68.4°
N29C28C27H24120.3°120.0°
N29C28C27H25120.3°120.0°
N29C28C27O2685.3°180.0°
N29C28C27H22156.2°60.0°
N29C28C27H2333.1°60.0°
N29C28H24H25118.9°120.0°
C28N29C30H264.0°0.0°
C28N29C33H293.2°0.2°
O12S11N14O13126.6°132.9°
O12S11N14C09119.0°113.6°
O12S11O13C09120.4°123.0°
O12S11C09C0820.1°142.3°
O12S11C09C10162.4°38.0°
O12S11N14H993.7°0.4°
N14S11O13C09116.0°114.1°
N14S11C09C08140.8°104.2°
N14S11C09C1041.8°75.5°
C28C27O26H22118.5°120.0°
C28C27O26H23118.4°120.0°
C28C27O26C25169.1°180.0°
C28C27H22H23124.4°120.0°
C27C28H24H25118.9°120.0°
O13S11C09C08105.0°9.3°
O13S11C09C1072.4°171.0°
O13S11N14H932.9°132.5°
S11C09C08C10177.3°179.7°
S11C09C08C07179.9°180.0°
S11C09C10C05179.2°179.7°
S11C09C08H70.1°0.1°
S11C09C10H80.8°0.3°
C09S11N14H9147.3°114.0°
C27O26C25C3438.9°180.0°
C27O26C25C24144.1°0.2°
O26C27H22H23124.4°120.0°
O26C27C28H2435.0°60.0°
O26C27C28H25154.4°60.0°
C09C08C07H7180.0°179.8°
C08C09C10C053.5°0.6°
C09C08C07C061.1°0.0°
C09C08C07H6178.9°180.0°
C08C09C10H8176.5°179.9°
C10C09C08C072.6°0.3°
C09C10C05H8180.0°179.5°
C09C10C05C063.1°0.5°
C09C10C05N04174.6°179.8°
C10C09C08H7177.4°179.8°
C08C07C06H6180.0°180.0°
C08C07C06C050.8°0.0°
C08C07C06H5179.3°180.0°
O26C25C34C24176.9°179.8°
O26C25C34C35178.1°180.0°
O26C25C24C23179.9°179.8°
O26C25C24H210.1°0.2°
C25O26C27H2272.4°60.0°
C25O26C27H2350.6°60.0°
O26C25C34H301.9°0.2°
C25C34C35H30180.0°179.8°
C34C25C24C233.0°0.0°
C25C34C35C221.0°0.5°
C34C25C24H21177.0°180.0°
C25C34C35H31178.9°180.0°
C24C25C34C351.2°0.2°
C25C24C23H21180.0°180.0°
C25C24C23C222.5°0.0°
C25C24C23H20177.5°180.0°
C24C25C34H30178.8°180.0°
C10C05C06C071.8°0.3°
C10C05C06N04177.9°179.7°
C10C05N04C0321.2°146.7°
C10C05N04H4158.8°33.3°
C10C05C06H5178.2°179.7°
C07C06C05H5180.0°180.0°
C07C06C05N04176.0°179.9°
C06C07C08H7178.9°179.9°
C34C35C22H31180.0°179.5°
C34C35C22C231.6°0.5°
C34C35C22N21180.0°179.8°
C24C23C22C350.2°0.2°
C24C23C22H20180.0°180.0°
C24C23C22N21178.1°180.0°
C35C22C23N21178.2°179.8°
C35C22N21C20173.8°38.7°
C35C22N21H196.2°141.2°
C35C22C23H20179.8°179.8°
C22C35C34H30178.9°179.7°
C23C22N21C207.8°141.5°
C23C22N21H19172.2°38.5°
C22C23C24H21177.5°180.0°
C23C22C35H31178.4°180.0°
C06C05N04C03161.0°33.6°
C06C05N04H419.0°146.4°
C05C06C07H6179.2°180.0°
C06C05C10H8177.0°180.0°
C05N04C03H4180.0°180.0°
C05N04C03N199.7°5.7°
C05N04C03C02169.9°174.3°
N04C05C06H53.9°0.0°
N04C05C10H85.4°0.3°
C22N21C20N199.1°173.7°
C22N21C20H19180.0°180.0°
C22N21C20N36168.9°6.3°
N21C22C23H202.0°0.0°
N21C22C35H310.0°0.2°
N04C03N19C02179.5°180.0°
N04C03N19C20178.8°180.0°
N04C03C02C37179.9°180.0°
N04C03C02C010.7°0.3°
C03N19C20N21179.3°180.0°
C03N19C20N362.8°0.1°
N19C03C02C370.6°0.0°
N19C03C02C01179.7°179.7°
N19C03N04H4170.3°174.3°
N19C20N21N36178.0°180.0°
C20N19C03C020.8°0.0°
N19C20N36C373.3°0.1°
N19C20N21H19171.0°6.3°
N21C20N36C37178.7°180.0°
C03C02C37N360.0°0.0°
C03C02C37C01179.2°179.7°
C03C02C01H189.5°89.7°
C03C02C01H2150.5°30.3°
C03C02C01H330.5°150.3°
C02C03N04H410.1°5.6°
C03C02C37H32179.9°179.7°
C20N36C37C021.8°0.0°
N36C20N21H1911.0°173.7°
C20N36C37H32178.2°179.7°
N36C37C02H32180.0°179.7°
N36C37C02C01179.3°179.7°
C37C02C01H189.6°90.0°
C37C02C01H230.4°150.0°
C37C02C01H3150.4°30.0°
C02C01H1H2120.0°119.9°
C02C01H1H3120.0°120.0°
C02C01H2H3120.0°120.0°
C01C02C37H320.7°0.0°
H1C01H2H3120.0°120.1°
H5C06C07H60.7°0.0°
H6C07C08H71.1°0.1°
H10C16H11H12120.0°120.0°
H13C17H14H15120.0°120.0°
H16C18H17H18120.0°120.1°
H20C23C24H212.5°0.0°
H22C27C28H2483.4°NaN°
H22C27C28H2535.9°60.0°
H23C27C28H24153.5°60.0°
H23C27C28H2587.2°180.0°
H26C30C31H270.4°0.2°
H27C31C32H281.7°0.3°
H28C32C33H292.6°0.3°
H30C34C35H311.1°0.2°

224931

PDB entries from 2024-09-11

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