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B69

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAACAPsing1.53Å1.53Å
CAPCAQsing1.53Å1.53Å
CAQCASsing1.53Å1.53Å
CASCAVsing1.51Å1.53Å
CAVCAIdoub1.38Å1.39ÅAromatic
CAVCAHsing1.38Å1.39ÅAromatic
CAICAMsing1.38Å1.39ÅAromatic
CAMCAXdoub1.39Å1.39ÅAromatic
CAHCALdoub1.38Å1.39ÅAromatic
CALCAXsing1.39Å1.39ÅAromatic
CAXCAYsing1.48Å1.39ÅAromatic
CAYCAOdoub1.39Å1.39ÅAromatic
CAYCANsing1.39Å1.39ÅAromatic
CAOCAKsing1.38Å1.39ÅAromatic
CAKCAWdoub1.38Å1.39ÅAromatic
CANCAJdoub1.38Å1.39ÅAromatic
CAJCAWsing1.38Å1.39ÅAromatic
CAWCATsing1.51Å1.53Å
CATCARsing1.53Å1.53Å
CARCAUsing1.53Å1.53Å
CAUCAZsing1.53Å1.53Å
CAZSBBsing1.81Å1.83Å
SBBOAGdoub1.42Å1.43Å
SBBOAFdoub1.42Å1.50Å
SBBOAEsing1.52Å1.50Å
PBAOABdoub1.48Å1.48Å
PBAOACsing1.61Å1.61Å
PBAOADsing1.61Å1.61Å
CAZPBAsing1.82Å1.84Å
CAAHAAsing1.09Å1.10Å
CAAHAAAsing1.09Å1.10Å
CAAHAABsing1.09Å1.10Å
CAPHAPsing1.09Å1.10Å
CAPHAPAsing1.09Å1.10Å
CAQHAQsing1.09Å1.10Å
CAQHAQAsing1.09Å1.10Å
CASHASsing1.09Å1.10Å
CASHASAsing1.09Å1.10Å
CAIHAIsing1.08Å1.08Å
CAMHAMsing1.08Å1.08Å
CAHHAHsing1.08Å1.08Å
CALHALsing1.08Å1.08Å
CAOHAOsing1.08Å1.08Å
CAKHAKsing1.08Å1.08Å
CANHANsing1.08Å1.08Å
CAJHAJsing1.08Å1.08Å
CATHATsing1.09Å1.10Å
CATHATAsing1.09Å1.10Å
CARHARsing1.09Å1.10Å
CARHARAsing1.09Å1.10Å
CAUHAUsing1.09Å1.10Å
CAUHAUAsing1.09Å1.10Å
CAZHAZsing1.09Å1.10Å
OACKOACsing2.36Å0.95Å
OADKOADsing2.36Å0.95Å
OAEKOAEsing2.36Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAACAPCAQ112.0°109.5°
CAPCAAHAA109.5°109.5°
CAPCAAHAAA109.5°109.5°
CAPCAAHAAB109.5°109.4°
CAACAPHAP108.6°109.4°
CAACAPHAPA108.1°109.4°
CAPCAQCAS107.9°109.5°
CAQCAPHAP108.7°109.5°
CAQCAPHAPA108.1°109.5°
CAPCAQHAQ110.0°109.5°
CAPCAQHAQA110.3°109.4°
CAQCASCAV116.1°109.5°
CASCAQHAQ110.0°109.5°
CASCAQHAQA110.3°109.5°
CAQCASHAS107.3°109.5°
CAQCASHASA105.8°109.5°
CASCAVCAI120.3°119.9°
CASCAVCAH119.2°119.9°
CAVCASHAS107.3°109.4°
CAVCASHASA105.8°109.5°
CAICAVCAH119.4°120.3°
CAVCAICAM120.4°120.1°
CAVCAIHAI119.8°119.9°
CAVCAHCAL120.1°120.1°
CAVCAHHAH119.9°119.9°
CAICAMCAX120.1°119.9°
CAMCAIHAI119.8°120.0°
CAICAMHAM120.0°120.1°
CAMCAXCAL119.4°119.7°
CAMCAXCAY121.3°120.1°
CAXCAMHAM120.0°120.1°
CAHCALCAX120.5°119.9°
CALCAHHAH119.9°119.9°
CAHCALHAL119.8°120.1°
CALCAXCAY119.1°120.1°
CAXCALHAL119.8°120.0°
CAXCAYCAO119.9°120.1°
CAXCAYCAN120.1°120.2°
CAOCAYCAN119.8°119.7°
CAYCAOCAK119.8°119.9°
CAYCAOHAO120.1°120.1°
CAYCANCAJ120.4°119.9°
CAYCANHAN119.8°120.0°
CAOCAKCAW120.4°120.1°
CAKCAOHAO120.1°120.1°
CAOCAKHAK119.8°119.9°
CAKCAWCAJ119.8°120.2°
CAKCAWCAT119.6°119.9°
CAWCAKHAK119.8°119.9°
CANCAJCAW119.9°120.1°
CAJCANHAN119.8°120.0°
CANCAJHAJ120.1°120.0°
CAJCAWCAT120.7°119.9°
CAWCAJHAJ120.1°119.9°
CAWCATCAR111.5°109.5°
CAWCATHAT108.8°109.4°
CAWCATHATA108.3°109.4°
CATCARCAU111.1°109.5°
CARCATHAT108.8°109.5°
CARCATHATA108.4°109.5°
CATCARHAR108.9°109.5°
CATCARHARA108.6°109.5°
CARCAUCAZ113.0°109.5°
CAUCARHAR108.9°109.5°
CAUCARHARA108.6°109.5°
CARCAUHAU108.3°109.5°
CARCAUHAUA107.5°109.5°
CAUCAZSBB109.0°109.5°
CAUCAZPBA110.7°109.5°
CAZCAUHAU108.3°109.5°
CAZCAUHAUA107.5°109.4°
CAUCAZHAZ109.2°109.5°
CAZSBBOAG109.2°110.5°
CAZSBBOAF109.3°110.6°
CAZSBBOAE109.1°104.4°
SBBCAZPBA110.1°109.4°
SBBCAZHAZ109.8°109.5°
OAGSBBOAF109.7°121.0°
OAGSBBOAE110.0°104.3°
OAFSBBOAE109.4°104.3°
SBBOAEKOAE109.5°114.0°
OABPBAOAC111.6°109.5°
OABPBAOAD113.0°109.5°
OABPBACAZ111.5°109.5°
OACPBAOAD106.8°109.5°
OACPBACAZ107.4°109.4°
PBAOACKOAC109.5°114.0°
OADPBACAZ106.1°109.5°
PBAOADKOAD109.5°114.0°
PBACAZHAZ108.1°109.5°
HAACAAHAAA109.5°109.5°
HAACAAHAAB109.4°109.5°
HAAACAAHAAB109.5°109.4°
HAPCAPHAPA111.4°109.5°
HAQCAQHAQA108.3°109.5°
HASCASHASA114.8°109.5°
HATCATHATA111.1°109.5°
HARCARHARA110.7°109.5°
HAUCAUHAUA112.2°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAACAPCAQHAP120.0°120.0°
CAACAPCAQHAPA119.0°120.0°
CAACAPCAQCAS178.3°180.0°
CAPCAAHAAHAAA120.0°120.0°
CAPCAAHAAHAAB120.0°120.0°
CAPCAAHAAAHAAB120.0°119.9°
CAACAPHAPHAPA119.0°119.9°
CAACAPCAQHAQ58.3°60.0°
CAACAPCAQHAQA61.1°60.0°
CAPCAQCASHAQ120.0°120.0°
CAPCAQCASHAQA120.6°120.0°
CAPCAQCASCAV172.0°180.0°
CAQCAPCAAHAA109.4°180.0°
CAQCAPCAAHAAA10.6°60.0°
CAQCAPCAAHAAB130.6°60.0°
CAQCAPHAPHAPA119.0°120.0°
CAPCAQHAQHAQA120.6°120.0°
CAPCAQCASHAS68.0°60.0°
CAPCAQCASHASA55.0°60.0°
CAQCASCAVHAS120.0°120.0°
CAQCASCAVHASA117.0°120.0°
CAQCASCAVCAI79.0°90.0°
CAQCASCAVCAH113.0°90.3°
CASCAQCAPHAP61.7°60.0°
CASCAQCAPHAPA59.3°60.0°
CASCAQHAQHAQA120.6°120.0°
CAQCASHASHASA117.3°120.0°
CASCAVCAICAH168.0°179.7°
CASCAVCAICAM166.6°180.0°
CASCAVCAHCAL166.9°180.0°
CAVCASCAQHAQ52.0°60.0°
CAVCASCAQHAQA67.4°60.0°
CAVCASHASHASA117.3°120.0°
CASCAVCAIHAI13.4°0.0°
CASCAVCAHHAH13.2°0.0°
CAVCAICAMHAI180.0°180.0°
CAVCAICAMCAX0.6°0.0°
CAICAVCAHCAL1.3°0.3°
CAICAVCASHAS160.9°30.0°
CAICAVCASHASA37.9°150.0°
CAVCAICAMHAM179.4°180.0°
CAICAVCAHHAH178.7°179.7°
CAHCAVCAICAM1.4°0.3°
CAVCAHCALHAH180.0°180.0°
CAVCAHCALCAX0.4°0.0°
CAHCAVCASHAS7.1°149.7°
CAHCAVCASHASA130.1°29.7°
CAHCAVCAIHAI178.6°179.7°
CAVCAHCALHAL179.6°180.0°
CAICAMCAXHAM180.0°179.9°
CAICAMCAXCAL0.2°0.3°
CAICAMCAXCAY175.8°180.0°
CAMCAXCALCAH0.3°0.3°
CAMCAXCALCAY175.7°179.7°
CAMCAXCAYCAO153.5°180.0°
CAMCAXCAYCAN32.2°0.3°
CAXCAMCAIHAI179.4°180.0°
CAMCAXCALHAL179.6°179.7°
CAHCALCAXHAL180.0°179.9°
CAHCALCAXCAY176.0°180.0°
CALCAXCAYCAO31.0°0.3°
CALCAXCAYCAN143.4°180.0°
CALCAXCAMHAM179.7°179.7°
CAXCALCAHHAH179.6°180.0°
CAXCAYCAOCAN174.4°179.7°
CAXCAYCAOCAK173.3°180.0°
CAXCAYCANCAJ173.2°180.0°
CAYCAXCAMHAM4.2°0.1°
CAYCAXCALHAL4.0°0.1°
CAXCAYCAOHAO6.6°0.1°
CAXCAYCANHAN6.8°0.0°
CAYCAOCAKHAO180.0°179.9°
CAYCAOCAKCAW0.2°0.0°
CAOCAYCANCAJ1.1°0.3°
CAYCAOCAKHAK179.8°179.9°
CAOCAYCANHAN178.9°179.7°
CANCAYCAOCAK1.0°0.3°
CAYCANCAJHAN180.0°180.0°
CAYCANCAJCAW0.3°0.0°
CANCAYCAOHAO179.0°179.7°
CAYCANCAJHAJ179.7°180.0°
CAOCAKCAWHAK180.0°179.9°
CAOCAKCAWCAJ0.6°0.3°
CAOCAKCAWCAT177.9°180.0°
CAKCAWCAJCAN0.5°0.3°
CAKCAWCAJCAT178.5°179.7°
CAKCAWCATCAR77.9°90.0°
CAWCAKCAOHAO179.9°179.9°
CAKCAWCAJHAJ179.5°179.7°
CAKCAWCATHAT162.1°150.0°
CAKCAWCATHATA41.3°30.0°
CANCAJCAWHAJ180.0°180.0°
CANCAJCAWCAT177.9°180.0°
CAJCAWCATCAR103.7°89.7°
CAJCAWCAKHAK179.4°179.7°
CAWCAJCANHAN179.6°180.0°
CAJCAWCATHAT16.4°30.3°
CAJCAWCATHATA137.2°150.3°
CAWCATCARHAT120.0°120.0°
CAWCATCARHATA119.1°120.0°
CAWCATCARCAU152.0°180.0°
CATCAWCAKHAK2.1°0.1°
CATCAWCAJHAJ2.1°0.0°
CAWCATHATHATA119.1°119.9°
CAWCATCARHAR32.0°60.0°
CAWCATCARHARA88.7°60.0°
CATCARCAUHAR120.0°120.0°
CATCARCAUHARA119.3°120.0°
CATCARCAUCAZ65.4°NaN°
CARCATHATHATA119.2°120.0°
CATCARHARHARA119.3°120.0°
CATCARCAUHAU54.6°60.0°
CATCARCAUHAUA176.1°60.0°
CARCAUCAZHAU120.0°120.0°
CARCAUCAZHAUA118.5°120.0°
CARCAUCAZSBB153.7°65.0°
CARCAUCAZPBA85.1°175.0°
CAUCARCATHAT88.0°60.0°
CAUCARCATHATA32.9°60.0°
CAUCARHARHARA119.4°120.0°
CARCAUHAUHAUA118.6°120.0°
CARCAUCAZHAZ33.8°55.0°
CAUCAZSBBPBA121.5°120.0°
CAUCAZSBBHAZ119.6°120.1°
CAUCAZSBBOAG177.1°73.8°
CAUCAZSBBOAF62.9°63.0°
CAUCAZSBBOAE56.8°174.7°
CAUCAZPBAOAB58.7°66.9°
CAUCAZPBAOAC178.6°53.1°
CAUCAZPBAOAD64.7°173.0°
CAUCAZPBAHAZ119.6°120.0°
CAZCAUCARHAR174.7°60.0°
CAZCAUCARHARA54.0°60.0°
CAZCAUHAUHAUA118.6°120.0°
CAZSBBOAGOAF119.8°131.5°
CAZSBBOAGOAE119.7°111.7°
CAZSBBOAFOAE119.5°111.8°
SBBCAZPBAOAB179.3°53.0°
SBBCAZPBAOAC58.1°173.0°
SBBCAZPBAOAD55.9°67.0°
SBBCAZPBAHAZ119.9°120.0°
SBBCAZCAUHAU33.7°55.0°
SBBCAZCAUHAUA87.8°174.9°
CAZSBBOAEKOAE114.0°73.9°
OAGSBBOAFOAE120.8°116.8°
OAGSBBCAZPBA61.4°166.3°
OAGSBBCAZHAZ57.5°46.3°
OAGSBBOAEKOAE126.2°42.1°
OAFSBBCAZPBA58.7°57.0°
OAFSBBCAZHAZ177.5°177.0°
OAFSBBOAEKOAE5.6°170.0°
OAESBBCAZPBA178.4°54.7°
OAESBBCAZHAZ62.8°65.3°
OABPBAOACOAD124.0°120.0°
OABPBAOACCAZ122.6°120.0°
OABPBAOADCAZ122.5°120.0°
OABPBACAZHAZ60.9°173.0°
OABPBAOACKOAC7.1°60.0°
OABPBAOADKOAD59.3°174.5°
OACPBAOADCAZ114.4°120.0°
OACPBACAZHAZ61.8°67.0°
OACPBAOADKOAD63.8°54.5°
OADPBACAZHAZ175.8°53.0°
OADPBAOACKOAC116.8°60.0°
PBACAZCAUHAU154.9°65.0°
PBACAZCAUHAUA33.4°55.0°
CAZPBAOACKOAC129.7°180.0°
CAZPBAOADKOAD178.2°65.4°
HAACAAHAAAHAAB120.0°120.0°
HAACAACAPHAP10.6°60.0°
HAACAACAPHAPA131.7°60.0°
HAAACAACAPHAP130.6°60.1°
HAAACAACAPHAPA108.3°180.0°
HAABCAACAPHAP109.3°180.0°
HAABCAACAPHAPA11.7°60.0°
HAPCAPCAQHAQ178.3°180.0°
HAPCAPCAQHAQA58.9°60.0°
HAPACAPCAQHAQ60.7°60.0°
HAPACAPCAQHAQA179.9°180.0°
HAQCAQCASHAS172.0°180.0°
HAQCAQCASHASA65.0°60.0°
HAQACAQCASHAS52.7°59.9°
HAQACAQCASHASA175.6°180.0°
HAICAICAMHAM0.6°0.0°
HAHCAHCALHAL0.4°0.0°
HAOCAOCAKHAK0.1°0.0°
HANCANCAJHAJ0.4°0.0°
HATCATCARHAR152.0°180.0°
HATCATCARHARA31.3°60.0°
HATACATCARHAR87.1°60.0°
HATACATCARHARA152.2°180.0°
HARCARCAUHAU65.4°180.0°
HARCARCAUHAUA56.2°60.0°
HARACARCAUHAU173.9°60.0°
HARACARCAUHAUA64.5°180.0°
HAUCAUCAZHAZ86.2°175.0°
HAUACAUCAZHAZ152.3°65.0°

222926

PDB entries from 2024-07-24

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