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SummaryGeometryRelated PDB entries

A1B9Z

Bonds
First atomSecond atomBond order typeDistance
(experimental model)		Distance
(ideal model)		Properties
O01C02doub1.21Å1.16Å
C89C88doub1.38Å1.39ÅAromatic
C89C37sing1.38Å1.38ÅAromatic
C02C36sing1.51Å1.53Å
C88C40sing1.40Å1.38ÅAromatic
C36C37sing1.51Å1.57Å
C37C38doub1.38Å1.38ÅAromatic
C85C86doub1.38Å1.37ÅAromatic
C85C48sing1.38Å1.36ÅAromatic
C86C45sing1.40Å1.37ÅAromatic
C40C41sing1.48Å1.47Å
C40C39doub1.40Å1.38ÅAromatic
S87C41sing1.76Å1.67ÅAromatic
S87C44sing1.76Å1.66ÅAromatic
C41C42doub1.35Å1.39ÅAromatic
C49C48sing1.51Å1.50Å
C49C50sing1.51Å1.52Å
C38C39sing1.38Å1.38ÅAromatic
C48C47doub1.38Å1.38ÅAromatic
C44C45sing1.48Å1.52Å
C44C43doub1.35Å1.40ÅAromatic
C45C46doub1.40Å1.36ÅAromatic
C42C43sing1.37Å1.42ÅAromatic
C50O84doub1.21Å1.19Å
C47C46sing1.38Å1.37ÅAromatic
C36H2sing1.09Å1.10Å
C36H3sing1.09Å1.10Å
C38H4sing1.08Å1.08Å
C39H5sing1.08Å1.08Å
C42H6sing1.08Å1.08Å
C43H7sing1.08Å1.08Å
C46H8sing1.08Å1.08Å
C47H9sing1.08Å1.08Å
C49H10sing1.09Å1.10Å
C49H11sing1.09Å1.10Å
C85H13sing1.08Å1.08Å
C86H14sing1.08Å1.08Å
C88H15sing1.08Å1.08Å
C89H16sing1.08Å1.08Å
C02O2sing1.34Å1.44Å
C50O1sing1.34Å1.43Å
O2H1sing0.97Å0.95Å
O1H12sing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)		Angle
(ideal model)
O01C02C36120.1°120.0°
O01C02O2120.4°120.0°
C88C89C37119.2°120.2°
C89C88C40119.4°119.8°
C89C88H15120.3°120.1°
C88C89H16120.4°119.9°
C89C37C36119.0°119.9°
C89C37C38121.2°120.3°
C37C89H16120.4°119.9°
C02C36C37108.9°109.5°
C02C36H2109.6°109.5°
C02C36H3109.6°109.5°
C36C02O2119.5°120.1°
C88C40C41117.8°120.1°
C88C40C39121.2°119.7°
C40C88H15120.3°120.1°
C36C37C38119.8°119.9°
C37C36H2109.7°109.5°
C37C36H3109.6°109.5°
C37C38C39119.8°120.2°
C37C38H4120.1°119.9°
C86C85C48119.4°120.2°
C85C86C45119.4°119.8°
C86C85H13120.3°119.9°
C85C86H14120.3°120.1°
C85C48C49118.7°119.9°
C85C48C47121.4°120.3°
C48C85H13120.3°119.8°
C86C45C44116.6°120.1°
C86C45C46121.4°119.7°
C45C86H14120.3°120.1°
C41C40C39120.9°120.2°
C40C41S87121.4°125.2°
C40C41C42130.7°125.2°
C40C39C38119.1°119.8°
C40C39H5120.5°120.1°
C41S87C4498.4°91.0°
S87C41C42107.9°109.7°
S87C44C45122.4°125.2°
S87C44C43107.2°109.6°
C41C42C43112.5°114.8°
C41C42H6123.7°122.6°
C48C49C50108.8°109.4°
C49C48C47119.9°119.8°
C48C49H10109.6°109.4°
C48C49H11109.6°109.5°
C49C50O84120.3°120.1°
C50C49H10109.6°109.4°
C50C49H11109.6°109.5°
C49C50O1120.0°120.0°
C39C38H4120.1°119.9°
C38C39H5120.4°120.1°
C48C47C46119.0°120.2°
C48C47H9120.5°119.9°
C45C44C43130.4°125.2°
C44C45C46122.0°120.1°
C44C43C42114.0°114.9°
C44C43H7123.0°122.6°
C45C46C47119.3°119.8°
C45C46H8120.3°120.1°
C43C42H6123.8°122.6°
C42C43H7123.0°122.5°
O84C50O1119.7°120.0°
C47C46H8120.3°120.1°
C46C47H9120.5°119.9°
H2C36H3109.5°109.4°
H10C49H11109.5°109.5°
C02O2H1109.5°117.1°
C50O1H12109.5°117.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)		Torsion
(ideal model)
O01C02C36O2178.1°179.7°
O01C02C36C3744.9°0.3°
O01C02C36H275.1°120.3°
O01C02C36H3164.8°119.7°
O01C02O2H10.0°0.3°
C88C89C37H16180.0°179.5°
C89C88C40H15180.0°179.7°
C88C89C37C36179.7°179.8°
C88C89C37C380.2°0.6°
C89C88C40C41178.8°179.7°
C89C88C40C391.5°0.3°
C89C37C36C02112.9°90.3°
C37C89C88C400.5°0.6°
C89C37C36C38179.5°179.7°
C89C37C38C390.1°0.3°
C89C37C36H27.0°149.7°
C89C37C36H3127.2°29.7°
C89C37C38H4179.9°179.7°
C37C89C88H15179.5°179.7°
C02C36C37H2119.9°120.0°
C02C36C37H3119.9°120.0°
C02C36C37C3867.6°90.0°
C02C36H2H3120.3°120.0°
C36C02O2H1178.1°180.0°
C88C40C41C39177.3°180.0°
C88C40C41S8738.0°179.7°
C88C40C41C42144.2°0.0°
C88C40C39C381.6°0.0°
C88C40C39H5178.4°179.9°
C40C88C89H16179.5°179.9°
C36C37C38C39179.6°180.0°
C37C36H2H3120.3°120.0°
C36C37C38H40.4°0.0°
C36C37C89H160.3°0.3°
C37C36C02O2133.3°180.0°
C37C38C39C400.8°0.1°
C37C38C39H4180.0°180.0°
C38C37C36H2172.5°30.0°
C38C37C36H352.3°150.0°
C37C38C39H5179.2°179.9°
C38C37C89H16179.8°179.9°
C86C85C48H13180.0°179.6°
C85C86C45H14180.0°179.5°
C86C85C48C49179.6°179.8°
C86C85C48C470.1°0.2°
C85C86C45C44179.2°179.8°
C85C86C45C461.9°0.5°
C48C85C86C450.9°0.5°
C85C48C49C47179.6°180.0°
C85C48C49C50162.1°89.9°
C85C48C47C460.2°0.0°
C85C48C47H9179.8°180.0°
C85C48C49H1042.3°30.0°
C85C48C49H1178.0°150.1°
C48C85C86H14179.1°180.0°
C86C45C44S8738.3°180.0°
C86C45C44C46177.4°179.7°
C86C45C44C43142.2°0.3°
C86C45C46C472.0°0.3°
C86C45C46H8178.0°179.8°
C45C86C85H13179.1°179.9°
C40C41S87C42178.3°179.7°
C40C41S87C44178.9°180.0°
C41C40C39C38178.8°180.0°
C40C41C42C43178.7°180.0°
C41C40C39H51.2°0.1°
C40C41C42H61.3°0.0°
C41C40C88H151.2°0.0°
C39C40C41S87139.3°0.3°
C39C40C41C4238.5°180.0°
C40C39C38H5180.0°180.0°
C40C39C38H4179.1°180.0°
C39C40C88H15178.5°180.0°
C41S87C44C45180.0°179.9°
C41S87C44C430.4°0.3°
S87C41C42C430.6°0.3°
S87C41C42H6179.4°179.7°
C44S87C41C420.6°0.3°
S87C44C45C43179.5°179.7°
S87C44C45C46139.1°0.3°
S87C44C43C420.1°0.2°
S87C44C43H7179.9°179.8°
C41C42C43C440.3°0.0°
C41C42C43H6180.0°180.0°
C41C42C43H7179.7°180.0°
C48C49C50H10119.9°119.9°
C48C49C50H11119.9°120.0°
C48C49C50O8490.6°0.0°
C49C48C47C46179.4°180.0°
C49C48C47H90.5°0.1°
C48C49H10H11120.3°120.1°
C49C48C85H130.5°0.2°
C48C49C50O190.2°180.0°
C50C49C48C4718.2°90.0°
C49C50O84O1179.2°180.0°
C50C49H10H11120.3°120.0°
C49C50O1H12179.2°180.0°
C48C47C46C451.1°0.0°
C48C47C46H9180.0°179.9°
C48C47C46H8178.9°180.0°
C47C48C49H10138.1°150.1°
C47C48C49H11101.7°30.0°
C47C48C85H13179.9°179.8°
C45C44C43C42179.7°180.0°
C44C45C46C47179.2°180.0°
C45C44C43H70.3°0.0°
C44C45C46H80.8°0.1°
C44C45C86H140.8°0.3°
C43C44C45C4640.4°179.9°
C44C43C42H7180.0°180.0°
C44C43C42H6179.7°180.0°
C45C46C47H8180.0°179.9°
C45C46C47H9178.9°179.9°
C46C45C86H14178.1°180.0°
O84C50C49H10149.5°120.0°
O84C50C49H1129.3°120.0°
O84C50O1H120.0°0.0°
H2C36C02O2106.8°60.0°
H3C36C02O213.4°60.0°
H4C38C39H50.9°0.0°
H6C42C43H70.3°0.0°
H8C46C47H91.1°0.0°
H10C49C50O129.7°60.1°
H11C49C50O1149.9°60.0°
H13C85C86H140.9°0.4°
H15C88C89H160.5°0.2°

248636

PDB entries from 2026-02-04

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