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5BQ

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAMCAKsing1.53Å1.51Å
CAMCAOsing1.51Å1.40Å
CAKCALsing1.53Å1.51Å
CALCANsing1.51Å1.39Å
CAOOACdoub1.21Å1.24Å
CAOCATsing1.51Å1.42Å
CANCATsing1.52Å1.44Å
CANOABdoub1.21Å1.23Å
CATCAPsing1.51Å1.40Å
CLACAQsing1.74Å1.68Å
CAPOADdoub1.21Å1.23Å
CAPCASsing1.47Å1.40Å
CAQCASdoub1.40Å1.42ÅAromatic
CAQCAJsing1.38Å1.36ÅAromatic
CASCAIsing1.40Å1.39ÅAromatic
CAJCARdoub1.38Å1.37ÅAromatic
CAICAHdoub1.38Å1.40ÅAromatic
OAFSAUdoub1.42Å1.54Å
CARCAHsing1.38Å1.40ÅAromatic
CARSAUsing1.76Å1.72Å
SAUOAEdoub1.42Å1.52Å
SAUCAAsing1.81Å1.75Å
CALH1sing1.09Å1.10Å
CALH2sing1.09Å1.10Å
CAKH3sing1.09Å1.10Å
CAKH4sing1.09Å1.10Å
CAMH5sing1.09Å1.10Å
CAMH6sing1.09Å1.10Å
CATH7sing1.09Å1.10Å
CAJH8sing1.08Å1.08Å
CAAH9sing1.09Å1.10Å
CAAH10sing1.09Å1.10Å
CAAH11sing1.09Å1.10Å
CAHH12sing1.08Å1.08Å
CAIH13sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAKCAMCAO111.1°109.0°
CAMCAKCAL104.9°109.6°
CAMCAKH3110.6°109.4°
CAMCAKH4110.6°109.4°
CAKCAMH5109.0°109.6°
CAKCAMH6109.0°109.6°
CAMCAOOAC117.3°121.0°
CAMCAOCAT122.7°118.1°
CAOCAMH5109.1°109.5°
CAOCAMH6109.1°109.5°
CAKCALCAN112.0°109.0°
CAKCALH1108.8°109.5°
CAKCALH2108.8°109.6°
CALCAKH3110.6°109.5°
CALCAKH4110.6°109.4°
CALCANCAT121.9°118.1°
CALCANOAB116.0°120.9°
CANCALH1108.8°109.6°
CANCALH2108.8°109.5°
OACCAOCAT119.8°120.9°
CAOCATCAN113.7°107.4°
CAOCATCAP106.3°110.1°
CAOCATH7107.0°109.7°
CATCANOAB122.2°121.0°
CANCATCAP115.2°109.8°
CANCATH7106.9°109.9°
CATCAPOAD116.8°120.0°
CATCAPCAS123.4°120.0°
CAPCATH7107.3°109.9°
CLACAQCAS124.2°120.1°
CLACAQCAJ113.2°120.1°
OADCAPCAS115.9°120.0°
CAPCASCAQ114.8°120.2°
CAPCASCAI126.3°120.2°
CASCAQCAJ122.5°119.8°
CAQCASCAI116.7°119.6°
CAQCAJCAR119.4°120.2°
CAQCAJH8120.3°119.9°
CASCAICAH120.0°119.9°
CASCAIH13120.0°120.0°
CAJCARCAH120.2°120.4°
CAJCARSAU114.2°119.8°
CARCAJH8120.3°119.9°
CAICAHCAR119.8°120.2°
CAICAHH12120.1°119.9°
CAHCAIH13120.0°120.1°
OAFSAUCAR108.1°104.3°
OAFSAUOAE108.2°121.1°
OAFSAUCAA109.4°110.5°
CAHCARSAU125.6°119.8°
CARCAHH12120.1°119.9°
CARSAUOAE110.0°104.2°
CARSAUCAA110.5°104.5°
OAESAUCAA110.5°110.5°
SAUCAAH9109.5°109.5°
SAUCAAH10109.5°109.5°
SAUCAAH11109.5°109.5°
H1CALH2109.5°109.6°
H3CAKH4109.5°109.4°
H5CAMH6109.5°109.6°
H9CAAH10109.5°109.5°
H9CAAH11109.4°109.4°
H10CAAH11109.4°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAKCAMCAOH5120.2°119.9°
CAKCAMCAOH6120.2°119.9°
CAMCAKCALH3119.3°120.1°
CAMCAKCALH4119.3°120.0°
CAMCAKCALCAN59.1°58.3°
CAKCAMCAOOAC151.1°125.3°
CAKCAMCAOCAT24.3°54.8°
CAMCAKCALH1179.5°178.2°
CAMCAKCALH261.2°61.6°
CAMCAKH3H4122.1°119.8°
CAKCAMH5H6119.2°120.3°
CAOCAMCAKCAL59.2°58.3°
CAMCAOOACCAT175.6°180.0°
CAMCAOCATCAN13.9°46.4°
CAMCAOCATCAP141.7°166.0°
CAOCAMCAKH360.1°61.8°
CAOCAMCAKH4178.5°178.3°
CAOCAMH5H6119.3°120.2°
CAMCAOCATH7103.8°72.9°
CAKCALCANH1120.4°119.8°
CAKCALCANH2120.4°119.9°
CAKCALCANCAT23.4°54.8°
CAKCALCANOAB157.3°125.5°
CAKCALH1H2118.8°120.3°
CALCAKH3H4122.1°120.0°
CALCAKCAMH561.1°178.2°
CALCAKCAMH6179.4°61.6°
CALCANCATCAO14.4°46.5°
CALCANCATOAB179.2°179.7°
CALCANCATCAP137.5°166.2°
CANCALH1H2118.8°120.2°
CANCALCAKH360.2°61.8°
CANCALCAKH4178.4°178.3°
CALCANCATH7103.5°72.8°
OACCAOCATCAN170.8°133.6°
OACCAOCATCAP43.0°14.0°
OACCAOCAMH588.6°5.4°
OACCAOCAMH630.9°114.8°
OACCAOCATH771.5°107.0°
CAOCATCANCAP123.1°119.7°
CAOCATCANH7117.8°119.3°
CAOCATCANOAB164.9°133.9°
CAOCATCAPH7114.2°120.9°
CAOCATCAPOAD123.1°88.1°
CAOCATCAPCAS80.0°92.0°
CATCAOCAMH595.9°174.6°
CATCAOCAMH6144.5°65.1°
CANCATCAPH7118.8°121.0°
CANCATCAPOAD3.9°30.0°
CANCATCAPCAS153.1°150.0°
CATCANCALH1143.8°174.6°
CATCANCALH296.9°65.1°
OABCANCATCAP41.8°14.1°
OABCANCALH136.9°5.7°
OABCANCALH282.3°114.5°
OABCANCATH777.3°106.9°
CATCAPOADCAS158.7°180.0°
CATCAPCASCAQ146.0°179.7°
CATCAPCASCAI16.7°0.1°
CLACAQCASCAP8.9°0.1°
CLACAQCASCAJ175.1°180.0°
CLACAQCASCAI173.3°179.7°
CLACAQCAJCAR180.0°180.0°
CLACAQCAJH80.0°0.0°
OADCAPCASCAQ56.9°0.3°
OADCAPCASCAI140.4°180.0°
OADCAPCATH7122.7°151.0°
CAPCASCAQCAI164.4°179.6°
CAPCASCAQCAJ176.1°180.0°
CAPCASCAICAH176.5°179.8°
CASCAPCATH734.2°29.0°
CAPCASCAIH133.5°0.1°
CASCAQCAJCAR4.4°0.1°
CAQCASCAICAH14.0°0.6°
CASCAQCAJH8175.6°180.0°
CAQCASCAIH13165.9°179.7°
CAJCAQCASCAI11.6°0.3°
CAQCAJCARH8180.0°180.0°
CAQCAJCARCAH0.5°0.0°
CAQCAJCARSAU179.8°180.0°
CASCAICAHH13180.0°179.7°
CASCAICAHCAR9.8°0.5°
CASCAICAHH12170.2°179.7°
CAJCARCAHCAI2.2°0.2°
CAJCARSAUOAF60.3°26.1°
CAJCARCAHSAU179.2°180.0°
CAJCARSAUOAE57.7°153.9°
CAJCARSAUCAA180.0°90.0°
CAJCARCAHH12177.8°180.0°
CAICAHCARH12180.0°179.8°
CAICAHCARSAU177.0°179.7°
OAFSAUCARCAH118.9°154.0°
OAFSAUCAROAE118.0°127.9°
OAFSAUCARCAA119.7°116.1°
OAFSAUOAECAA119.7°131.5°
OAFSAUCAAH9180.0°171.6°
OAFSAUCAAH1060.0°68.4°
OAFSAUCAAH1160.0°51.6°
CAHCARSAUOAE123.1°26.1°
CAHCARSAUCAA0.7°90.0°
CAHCARCAJH8179.5°180.0°
CARCAHCAIH13170.2°179.8°
CARSAUOAECAA122.3°111.7°
SAUCARCAJH80.2°0.0°
CARSAUCAAH961.1°60.0°
CARSAUCAAH10178.9°180.0°
CARSAUCAAH1158.9°60.0°
SAUCARCAHH123.0°0.0°
OAESAUCAAH961.0°51.6°
OAESAUCAAH1059.1°68.4°
OAESAUCAAH11179.0°171.6°
SAUCAAH9H10120.0°120.0°
SAUCAAH9H11120.0°120.0°
SAUCAAH10H11120.0°120.0°
H1CALCAKH360.2°58.1°
H1CALCAKH461.2°61.9°
H2CALCAKH3179.5°178.4°
H2CALCAKH458.0°58.4°
H3CAKCAMH5179.7°58.0°
H3CAKCAMH660.2°178.3°
H4CAKCAMH558.2°61.8°
H4CAKCAMH661.3°58.5°
H9CAAH10H11119.9°120.0°
H12CAHCAIH139.8°0.0°

223532

PDB entries from 2024-08-07

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