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9UY

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
O1DCGDdoub1.21Å1.25Å
O2ACGAdoub1.21Å1.24Å
CGDO2Dsing1.34Å1.24Å
CGDCBDsing1.51Å1.52Å
CADCBDsing1.53Å1.55Å
CADC3Dsing1.51Å1.50Å
CGAO1Asing1.34Å1.20Å
CGACBAsing1.51Å1.50Å
CAACBAsing1.53Å1.52Å
CAAC2Asing1.51Å1.50Å
C3DC2Dsing1.41Å1.46ÅAromatic
C3DC4Ddoub1.35Å1.46ÅAromatic
CMDC2Dsing1.51Å1.49Å
CHAC4Dsing1.51Å1.48Å
CHAC1Asing1.51Å1.47Å
C2DC1Ddoub1.35Å1.47ÅAromatic
C2AC1Adoub1.35Å1.47ÅAromatic
C2AC3Asing1.41Å1.44ÅAromatic
C4DNDsing1.36Å1.37ÅAromatic
C1ANAsing1.36Å1.35ÅAromatic
CMAC3Asing1.51Å1.49Å
C3AC4Adoub1.35Å1.46ÅAromatic
C1DNDsing1.36Å1.36ÅAromatic
C1DCHDsing1.51Å1.49Å
NAC4Asing1.36Å1.35ÅAromatic
CHDC4Csing1.51Å1.35Å
C4ACHBsing1.51Å1.46Å
CHBC1Bsing1.51Å1.49Å
C4CC3Csing1.51Å1.51Å
C4CNCdoub1.29Å1.33Å
C3CCACsing1.51Å1.50Å
C3CC2Csing1.54Å1.52Å
NCC1Csing1.34Å1.33Å
C1BNBdoub1.31Å1.35Å
C1BC2Bsing1.41Å1.48Å
NBC4Bsing1.35Å1.36Å
CACCBCdoub1.31Å1.31Å
CMCC2Csing1.53Å1.53Å
C2CC1Csing1.52Å1.50Å
C2BCMBsing1.51Å1.50Å
C2BC3Bdoub1.37Å1.47Å
C4BOBdoub1.21Å1.27Å
C4BC3Bsing1.50Å1.49Å
C1COCdoub1.21Å1.21Å
C3BCABsing1.42Å1.51Å
CABCBBdoub1.34Å1.33Å
O2DH1sing0.97Å0.95Å
CBDH2sing1.09Å1.10Å
CBDH3sing1.09Å1.10Å
CADH4sing1.09Å1.10Å
CADH5sing1.09Å1.10Å
CMDH6sing1.09Å1.10Å
CMDH7sing1.09Å1.10Å
CMDH8sing1.09Å1.10Å
CHDH9sing1.09Å1.10Å
CHDH10sing1.09Å1.10Å
C3CH11sing1.09Å1.10Å
CACH12sing1.08Å1.08Å
CBCH13sing1.08Å1.08Å
CBCH14sing1.08Å1.08Å
C2CH15sing1.09Å1.10Å
CMCH16sing1.09Å1.10Å
CMCH17sing1.09Å1.10Å
CMCH18sing1.09Å1.10Å
NDH19sing0.97Å1.00Å
CHAH20sing1.09Å1.10Å
CHAH21sing1.09Å1.10Å
CAAH22sing1.09Å1.10Å
CAAH23sing1.09Å1.10Å
CBAH24sing1.09Å1.10Å
CBAH25sing1.09Å1.10Å
O1AH26sing0.97Å0.95Å
CMAH27sing1.09Å1.10Å
CMAH28sing1.09Å1.10Å
CMAH29sing1.09Å1.10Å
NAH30sing0.97Å1.00Å
CHBH31sing1.09Å1.10Å
CHBH32sing1.09Å1.10Å
CMBH33sing1.09Å1.10Å
CMBH34sing1.09Å1.10Å
CMBH35sing1.09Å1.10Å
CABH36sing1.08Å1.08Å
CBBH37sing1.08Å1.08Å
CBBH38sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1DCGDO2D122.0°120.0°
O1DCGDCBD119.4°120.0°
O2ACGAO1A123.8°120.0°
O2ACGACBA118.9°120.0°
O2DCGDCBD118.6°120.0°
CGDO2DH1109.5°117.0°
CGDCBDCAD109.1°109.4°
CGDCBDH2109.6°109.5°
CGDCBDH3109.6°109.5°
CBDCADC3D110.0°109.5°
CADCBDH2109.6°109.5°
CADCBDH3109.6°109.4°
CBDCADH4109.3°109.5°
CBDCADH5109.4°109.5°
CADC3DC2D126.4°126.3°
CADC3DC4D129.3°126.3°
C3DCADH4109.3°109.4°
C3DCADH5109.3°109.5°
O1ACGACBA117.3°120.0°
CGAO1AH26109.5°117.1°
CGACBACAA115.5°109.4°
CGACBAH24108.0°109.5°
CGACBAH25108.0°109.5°
CBACAAC2A105.7°109.5°
CBACAAH22110.4°109.4°
CBACAAH23110.4°109.5°
CAACBAH24107.9°109.4°
CAACBAH25107.9°109.5°
CAAC2AC1A130.0°126.3°
CAAC2AC3A125.7°126.3°
C2ACAAH22110.4°109.5°
C2ACAAH23110.4°109.5°
C2DC3DC4D104.2°107.4°
C3DC2DCMD128.5°126.3°
C3DC2DC1D104.5°107.5°
C3DC4DCHA120.3°125.9°
C3DC4DND112.6°108.2°
CMDC2DC1D126.9°126.3°
C2DCMDH6109.5°109.4°
C2DCMDH7109.5°109.5°
C2DCMDH8109.5°109.4°
C4DCHAC1A129.3°109.5°
CHAC4DND127.1°125.9°
C4DCHAH20104.3°109.5°
C4DCHAH21104.3°109.5°
CHAC1AC2A121.9°125.9°
CHAC1ANA124.8°125.9°
C1ACHAH20104.3°109.5°
C1ACHAH21104.3°109.4°
C2DC1DND112.3°108.2°
C2DC1DCHD120.6°125.9°
C1AC2AC3A104.3°107.4°
C2AC1ANA113.4°108.2°
C2AC3ACMA126.6°126.3°
C2AC3AC4A103.2°107.4°
C4DNDC1D106.3°108.7°
C4DNDH19126.8°125.6°
C1ANAC4A105.0°108.7°
C1ANAH30127.5°125.6°
CMAC3AC4A130.2°126.3°
C3ACMAH27109.5°109.5°
C3ACMAH28109.5°109.5°
C3ACMAH29109.5°109.5°
C3AC4ANA114.1°108.2°
C3AC4ACHB125.5°125.9°
NDC1DCHD127.0°125.9°
C1DNDH19126.8°125.7°
C1DCHDC4C129.5°109.5°
C1DCHDH9104.2°109.5°
C1DCHDH10104.2°109.4°
NAC4ACHB120.3°125.8°
C4ANAH30127.5°125.7°
CHDC4CC3C121.7°125.1°
CHDC4CNC128.5°125.0°
C4CCHDH9104.2°109.5°
C4CCHDH10104.3°109.5°
C4ACHBC1B124.7°109.5°
C4ACHBH31105.5°109.5°
C4ACHBH32105.5°109.4°
CHBC1BNB124.2°124.6°
CHBC1BC2B121.5°124.6°
C1BCHBH31105.5°109.5°
C1BCHBH32105.6°109.5°
C3CC4CNC109.8°109.9°
C4CC3CCAC106.6°110.6°
C4CC3CC2C104.0°103.2°
C4CC3CH11111.9°110.7°
C4CNCC1C112.2°115.6°
CACC3CC2C110.3°110.7°
C3CCACCBC119.0°120.0°
CACC3CH11111.9°110.6°
C3CCACH12120.5°120.0°
C3CC2CCMC117.7°110.8°
C3CC2CC1C101.9°102.7°
C2CC3CH11111.7°110.8°
C3CC2CH15107.2°110.7°
NCC1CC2C111.5°108.6°
NCC1COC125.7°125.7°
NBC1BC2B114.2°110.8°
C1BNBC4B104.5°110.2°
C1BC2BCMB125.6°126.3°
C1BC2BC3B104.3°107.3°
NBC4BOB121.0°126.7°
NBC4BC3B115.2°106.5°
CBCCACH12120.5°120.0°
CACCBCH13120.0°120.0°
CACCBCH14120.0°120.0°
CMCC2CC1C114.8°110.8°
CMCC2CH15107.1°110.8°
C2CCMCH16109.5°109.5°
C2CCMCH17109.5°109.5°
C2CCMCH18109.5°109.5°
C2CC1COC122.7°125.7°
C1CC2CH15107.5°110.8°
CMBC2BC3B130.1°126.4°
C2BCMBH33109.5°109.5°
C2BCMBH34109.5°109.5°
C2BCMBH35109.5°109.5°
C2BC3BC4B101.7°105.1°
C2BC3BCAB122.1°127.4°
OBC4BC3B123.8°126.8°
C4BC3BCAB136.1°127.4°
C3BCABCBB131.8°120.0°
C3BCABH36114.1°120.0°
CBBCABH36114.1°120.0°
CABCBBH37120.0°120.0°
CABCBBH38120.0°120.0°
H2CBDH3109.5°109.5°
H4CADH5109.5°109.4°
H6CMDH7109.5°109.5°
H6CMDH8109.5°109.5°
H7CMDH8109.5°109.5°
H9CHDH10109.5°109.4°
H13CBCH14120.0°120.0°
H16CMCH17109.4°109.4°
H16CMCH18109.5°109.5°
H17CMCH18109.5°109.5°
H20CHAH21109.5°109.4°
H22CAAH23109.5°109.5°
H24CBAH25109.5°109.5°
H27CMAH28109.4°109.5°
H27CMAH29109.4°109.5°
H28CMAH29109.5°109.5°
H31CHBH32109.5°109.4°
H33CMBH34109.5°109.4°
H33CMBH35109.4°109.4°
H34CMBH35109.5°109.5°
H37CBBH38120.0°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1DCGDO2DCBD177.3°179.9°
O1DCGDCBDCAD73.1°0.0°
O1DCGDO2DH10.0°0.1°
O1DCGDCBDH246.8°120.0°
O1DCGDCBDH3166.9°119.9°
O2ACGAO1ACBA178.5°180.0°
O2ACGACBACAA4.5°0.1°
O2ACGACBAH24125.4°120.0°
O2ACGACBAH25116.4°119.9°
O2ACGAO1AH260.0°0.0°
O2DCGDCBDCAD104.2°180.0°
O2DCGDCBDH2135.8°60.0°
O2DCGDCBDH315.7°60.0°
CGDCBDCADH2119.9°120.0°
CGDCBDCADH3119.9°120.0°
CGDCBDCADC3D171.3°180.0°
CBDCGDO2DH1177.3°180.0°
CGDCBDH2H3120.2°120.0°
CGDCBDCADH451.2°60.0°
CGDCBDCADH568.6°60.0°
CBDCADC3DH4120.1°120.0°
CBDCADC3DH5120.1°120.1°
CBDCADC3DC2D108.3°90.0°
CBDCADC3DC4D71.1°90.2°
CADCBDH2H3120.2°120.0°
CBDCADH4H5119.8°120.0°
CADC3DC2DC4D179.5°179.8°
CADC3DC2DCMD1.5°0.0°
CADC3DC4DCHA1.4°0.1°
CADC3DC2DC1D180.0°179.9°
CADC3DC4DND179.8°179.8°
C3DCADCBDH268.8°60.0°
C3DCADCBDH351.4°60.0°
C3DCADH4H5119.8°120.0°
O1ACGACBACAA176.9°180.0°
O1ACGACBAH2456.1°60.0°
O1ACGACBAH2562.2°60.1°
CGACBACAAH24120.9°120.0°
CGACBACAAH25120.9°120.0°
CGACBACAAC2A177.3°180.0°
CGACBACAAH2263.3°60.0°
CGACBACAAH2357.9°60.0°
CGACBAH24H25117.3°120.1°
CBACGAO1AH26178.5°180.0°
CBACAAC2AH22119.4°119.9°
CBACAAC2AH23119.4°120.0°
CBACAAC2AC1A93.6°90.0°
CBACAAC2AC3A84.0°89.9°
CBACAAH22H23121.7°120.0°
CAACBAH24H25117.2°120.0°
CAAC2AC1ACHA0.6°0.1°
CAAC2AC1AC3A178.1°179.9°
CAAC2AC1ANA178.3°179.7°
CAAC2AC3ACMA4.1°0.0°
CAAC2AC3AC4A177.5°179.9°
C2ACAAH22H23121.8°120.0°
C2ACAACBAH2456.4°60.0°
C2ACAACBAH2561.9°60.0°
C3DC2DCMDC1D178.1°179.9°
C2DC3DC4DCHA179.2°179.7°
C2DC3DC4DND0.3°0.4°
C3DC2DC1DND0.6°0.0°
C3DC2DC1DCHD177.4°179.9°
C2DC3DCADH411.8°30.0°
C2DC3DCADH5131.6°149.9°
C3DC2DCMDH689.0°90.0°
C3DC2DCMDH7150.9°150.0°
C3DC2DCMDH831.0°30.0°
C4DC3DC2DCMD179.0°179.8°
C3DC4DCHAND178.7°179.9°
C3DC4DCHAC1A178.1°85.0°
C4DC3DC2DC1D0.5°0.3°
C3DC4DNDC1D0.1°0.4°
C4DC3DCADH4168.9°149.8°
C4DC3DCADH549.0°29.8°
C3DC4DNDH19179.9°179.8°
C3DC4DCHAH2055.5°154.9°
C3DC4DCHAH2159.3°34.9°
CMDC2DC1DND179.1°180.0°
CMDC2DC1DCHD4.1°0.1°
C2DCMDH6H7120.0°120.0°
C2DCMDH6H8120.0°120.0°
C2DCMDH7H8120.0°120.0°
C4DCHAC1AH20122.6°120.0°
C4DCHAC1AH21122.6°120.0°
C4DCHAC1AC2A174.0°85.2°
C4DCHAC1ANA7.2°95.0°
CHAC4DNDC1D178.7°179.7°
CHAC4DNDH191.3°0.1°
C4DCHAH20H21111.2°120.0°
CHAC1AC2ANA178.9°179.8°
CHAC1AC2AC3A178.6°180.0°
C1ACHAC4DND0.6°94.8°
CHAC1ANAC4A177.7°179.8°
C1ACHAH20H21111.1°120.0°
CHAC1ANAH302.3°0.1°
C2DC1DNDC4D0.4°0.2°
C2DC1DNDCHD176.5°179.9°
C2DC1DCHDC4C161.6°84.9°
C1DC2DCMDH689.1°90.1°
C1DC2DCMDH730.9°30.0°
C1DC2DCMDH8150.9°150.0°
C2DC1DCHDH939.0°155.0°
C2DC1DCHDH1075.8°35.1°
C2DC1DNDH19179.6°180.0°
C1AC2AC3ACMA177.7°179.9°
C1AC2AC3AC4A0.7°0.0°
C2AC1ANAC4A1.2°0.4°
C2AC1ACHAH2051.4°34.8°
C2AC1ACHAH2163.5°154.8°
C1AC2ACAAH2225.7°150.1°
C1AC2ACAAH23147.0°30.1°
C2AC1ANAH30178.8°179.8°
C3AC2AC1ANA0.3°0.2°
C2AC3ACMAC4A178.0°179.9°
C2AC3AC4ANA1.6°0.2°
C2AC3AC4ACHB179.7°180.0°
C3AC2ACAAH22156.6°30.0°
C3AC2ACAAH2335.3°150.0°
C2AC3ACMAH2791.0°90.0°
C2AC3ACMAH28149.1°150.0°
C2AC3ACMAH2929.0°30.0°
C4DNDC1DH19180.0°179.8°
C4DNDC1DCHD177.0°179.7°
NDC4DCHAH20123.2°25.2°
NDC4DCHAH21122.0°145.2°
C1ANAC4AC3A1.7°0.4°
C1ANAC4AH30180.0°179.9°
C1ANAC4ACHB179.5°179.8°
NAC1ACHAH20129.8°145.0°
NAC1ACHAH21115.3°25.0°
CMAC3AC4ANA176.8°179.7°
CMAC3AC4ACHB2.0°0.1°
C3ACMAH27H28120.0°120.0°
C3ACMAH27H29120.0°120.0°
C3ACMAH28H29120.0°120.0°
C3AC4ANACHB178.8°179.8°
C3AC4ACHBC1B37.9°85.0°
C4AC3ACMAH2791.1°90.0°
C4AC3ACMAH2828.9°30.1°
C4AC3ACMAH29148.9°150.1°
C3AC4ANAH30178.3°179.8°
C3AC4ACHBH31159.9°154.9°
C3AC4ACHBH3284.2°35.0°
NDC1DCHDC4C14.7°95.0°
NDC1DCHDH9137.3°25.1°
NDC1DCHDH10107.9°145.0°
C1DCHDC4CH9122.6°120.0°
C1DCHDC4CH10122.6°120.0°
C1DCHDC4CC3C173.2°180.0°
C1DCHDC4CNC4.5°0.3°
C1DCHDH9H10111.0°119.9°
CHDC1DNDH193.1°0.1°
NAC4ACHBC1B143.5°94.8°
NAC4ACHBH3121.4°25.3°
NAC4ACHBH3294.5°145.2°
CHDC4CC3CNC178.1°179.7°
CHDC4CC3CCAC70.1°61.6°
CHDC4CC3CC2C173.3°180.0°
CHDC4CNCC1C177.8°179.8°
C4CCHDH9H10111.1°120.0°
CHDC4CC3CH1152.6°61.3°
C4ACHBC1BH31122.0°120.1°
C4ACHBC1BH32122.1°120.0°
C4ACHBC1BNB7.2°0.0°
C4ACHBC1BC2B168.3°179.7°
CHBC4ANAH300.5°0.0°
C4ACHBH31H32113.2°119.9°
CHBC1BNBC2B175.9°179.8°
CHBC1BNBC4B176.6°179.8°
CHBC1BC2BCMB2.9°0.0°
CHBC1BC2BC3B175.7°180.0°
C1BCHBH31H32113.2°120.0°
C4CC3CCACC2C112.4°113.8°
C4CC3CCACH11122.7°123.0°
C4CC3CC2CH11120.8°118.5°
C3CC4CNCC1C0.2°0.5°
C4CC3CCACCBC75.9°121.5°
C4CC3CC2CCMC119.6°118.3°
C4CC3CC2CC1C6.9°0.0°
C3CC4CCHDH964.2°60.0°
C3CC4CCHDH1050.6°60.0°
C4CC3CCACH12104.1°58.6°
C4CC3CC2CH15119.6°118.3°
NCC4CC3CCAC111.8°118.7°
NCC4CC3CC2C4.8°0.3°
C4CNCC1CC2C4.8°0.5°
C4CNCC1COC173.1°179.8°
NCC4CCHDH9118.1°120.4°
NCC4CCHDH10127.1°119.7°
NCC4CC3CH11125.5°118.4°
CACC3CC2CH11125.1°123.1°
C3CCACCBCH12180.0°180.0°
CACC3CC2CCMC126.4°123.3°
CACC3CC2CC1C107.1°118.4°
C3CCACCBCH13180.0°0.0°
C3CCACCBCH140.0°180.0°
CACC3CC2CH155.6°0.1°
C3CC2CC1CNC7.4°0.3°
C2CC3CCACCBC36.5°124.8°
C3CC2CCMCC1C119.9°113.3°
C3CC2CCMCH15120.8°123.3°
C3CC2CC1CH15112.6°118.3°
C3CC2CC1COC170.6°180.0°
C2CC3CCACH12143.5°55.2°
C3CC2CCMCH16180.0°60.1°
C3CC2CCMCH1760.0°180.0°
C3CC2CCMCH1860.0°60.0°
NCC1CC2CCMC121.0°118.1°
NCC1CC2COC178.0°179.7°
NCC1CC2CH15120.0°118.5°
NBC1BC2BCMB178.9°179.8°
NBC1BC2BC3B0.3°0.3°
C1BNBC4BOB179.1°179.9°
C1BNBC4BC3B1.7°0.4°
NBC1BCHBH31114.8°120.0°
NBC1BCHBH32129.3°120.0°
C2BC1BNBC4B0.8°0.5°
C1BC2BCMBC3B178.2°180.0°
C1BC2BC3BC4B1.2°0.0°
C1BC2BC3BCAB178.0°180.0°
C2BC1BCHBH3169.6°60.3°
C2BC1BCHBH3246.3°59.7°
C1BC2BCMBH33180.0°90.0°
C1BC2BCMBH3460.0°150.0°
C1BC2BCMBH3560.0°29.9°
NBC4BC3BC2B1.8°0.3°
NBC4BOBC3B177.2°179.6°
NBC4BC3BCAB178.0°179.8°
CBCCACC3CH11161.5°1.5°
CACCBCH13H14180.0°180.0°
CMCC2CC1CH15119.0°123.4°
CMCC2CC1COC61.0°61.7°
CMCC2CC3CH111.2°0.2°
C2CCMCH16H17120.0°120.0°
C2CCMCH16H18120.0°120.0°
C2CCMCH17H18120.0°120.0°
C1CC2CC3CH11127.7°118.5°
C1CC2CCMCH1660.1°53.2°
C1CC2CCMCH17179.9°66.7°
C1CC2CCMCH1859.9°173.3°
CMBC2BC3BC4B179.7°179.9°
CMBC2BC3BCAB3.5°0.0°
C2BCMBH33H34120.0°120.0°
C2BCMBH33H35120.0°120.0°
C2BCMBH34H35120.0°120.1°
C2BC3BC4BOB179.2°179.9°
C2BC3BC4BCAB176.2°179.9°
C2BC3BCABCBB172.4°180.0°
C3BC2BCMBH331.8°90.0°
C3BC2BCMBH34121.8°30.0°
C3BC2BCMBH35118.2°150.0°
C2BC3BCABH367.6°0.0°
OBC4BC3BCAB4.6°0.1°
C4BC3BCABCBB12.0°0.0°
C4BC3BCABH36168.0°179.9°
OCC1CC2CH1558.0°61.7°
C3BCABCBBH36180.0°180.0°
C3BCABCBBH37180.0°0.0°
C3BCABCBBH380.0°180.0°
CABCBBH37H38180.0°179.9°
H2CBDCADH4171.2°180.0°
H2CBDCADH551.3°60.1°
H3CBDCADH468.7°60.0°
H3CBDCADH5171.5°179.9°
H6CMDH7H8120.0°120.1°
H11C3CCACH1218.5°178.4°
H11C3CC2CH15119.5°123.2°
H12CACCBCH130.0°179.9°
H12CACCBCH14180.0°0.0°
H15C2CCMCH1659.2°176.6°
H15C2CCMCH1760.8°56.7°
H15C2CCMCH18179.2°63.4°
H16CMCH17H18120.0°120.0°
H22CAACBAH24175.8°180.0°
H22CAACBAH2557.6°60.0°
H23CAACBAH2463.0°60.0°
H23CAACBAH25178.7°180.0°
H27CMAH28H29120.0°120.0°
H33CMBH34H35120.0°119.9°
H36CABCBBH370.0°180.0°
H36CABCBBH38180.0°0.1°

222415

PDB entries from 2024-07-10

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