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ER4

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAAOAVsing1.43Å1.43Å
OAVCAMsing1.43Å1.43Å
CAMCALsing1.53Å1.53Å
CALCANsing1.53Å1.53Å
CANOAWsing1.43Å1.43Å
OAWCAZsing1.36Å1.36Å
CAGCAEdoub1.38Å1.39ÅAromatic
CAGCAIsing1.38Å1.39ÅAromatic
CAECAFsing1.38Å1.39ÅAromatic
CAZNAUdoub1.32Å1.34ÅAromatic
CAZCAKsing1.39Å1.39ÅAromatic
CAICAXdoub1.38Å1.39ÅAromatic
NAUCBAsing1.32Å1.34ÅAromatic
CAFCAHdoub1.38Å1.39ÅAromatic
CAXCAHsing1.38Å1.39ÅAromatic
CAXCASsing1.51Å1.39Å
CAKCAJdoub1.38Å1.39ÅAromatic
CBACASsing1.51Å1.39Å
CBACAYdoub1.39Å1.39ÅAromatic
CAJCAYsing1.40Å1.39ÅAromatic
CAYCACsing1.43Å1.43Å
CACCADtrip1.17Å1.22Å
CAQCAOsing1.53Å1.52Å
CAQNBCsing1.47Å1.47Å
CAOCBBsing1.53Å1.52Å
CADCBDsing1.47Å1.47Å
NBCCATsing1.47Å1.47Å
NBCCARsing1.47Å1.47Å
CATCBDsing1.53Å1.52Å
CBDCBBsing1.53Å1.52Å
CBDOABsing1.43Å1.44Å
CBBCAPsing1.53Å1.52Å
CARCAPsing1.53Å1.52Å
CAQH1sing1.09Å1.10Å
CAQH2sing1.09Å1.10Å
CAOH3sing1.09Å1.10Å
CAOH4sing1.09Å1.10Å
CBBH5sing1.09Å1.10Å
CAPH6sing1.09Å1.10Å
CAPH7sing1.09Å1.10Å
CARH8sing1.09Å1.10Å
CARH9sing1.09Å1.10Å
CATH11sing1.09Å1.10Å
CATH12sing1.09Å1.10Å
OABH13sing0.97Å0.95Å
CAJH14sing1.08Å1.08Å
CAKH15sing1.08Å1.08Å
CANH16sing1.09Å1.10Å
CANH17sing1.09Å1.10Å
CALH18sing1.09Å1.10Å
CALH19sing1.09Å1.10Å
CAMH20sing1.09Å1.10Å
CAMH21sing1.09Å1.10Å
CAAH22sing1.09Å1.10Å
CAAH23sing1.09Å1.10Å
CAAH24sing1.09Å1.10Å
CASH25sing1.09Å1.10Å
CASH26sing1.09Å1.10Å
CAHH27sing1.08Å1.08Å
CAFH28sing1.08Å1.08Å
CAEH29sing1.08Å1.08Å
CAGH30sing1.08Å1.08Å
CAIH31sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAAOAVCAM109.4°114.1°
OAVCAAH22109.5°109.5°
OAVCAAH23109.4°109.5°
OAVCAAH24109.5°109.4°
OAVCAMCAL108.5°109.5°
OAVCAMH20109.7°109.4°
OAVCAMH21109.7°109.5°
CAMCALCAN111.0°109.5°
CAMCALH18109.1°109.5°
CAMCALH19109.1°109.5°
CALCAMH20109.7°109.5°
CALCAMH21109.7°109.5°
CALCANOAW106.7°109.5°
CALCANH16110.2°109.5°
CALCANH17110.1°109.4°
CANCALH18109.1°109.5°
CANCALH19109.1°109.4°
CANOAWCAZ113.7°117.0°
OAWCANH16110.2°109.5°
OAWCANH17110.2°109.5°
OAWCAZNAU121.3°119.6°
OAWCAZCAK117.7°119.5°
CAECAGCAI120.0°120.0°
CAGCAECAF119.9°120.0°
CAGCAEH29120.0°120.0°
CAECAGH30120.0°120.0°
CAGCAICAX120.1°120.0°
CAICAGH30120.0°120.0°
CAGCAIH31120.0°120.0°
CAECAFCAH120.0°120.0°
CAECAFH28120.0°120.0°
CAFCAEH29120.0°120.0°
NAUCAZCAK120.3°120.9°
CAZNAUCBA121.5°121.8°
CAZCAKCAJ119.6°119.2°
CAZCAKH15120.2°120.4°
CAICAXCAH119.8°120.0°
CAICAXCAS119.4°120.0°
CAXCAIH31120.0°120.0°
NAUCBACAS119.2°119.7°
NAUCBACAY120.4°120.6°
CAFCAHCAX120.1°120.0°
CAFCAHH27119.9°120.0°
CAHCAFH28120.0°120.0°
CAHCAXCAS120.2°120.1°
CAXCAHH27119.9°119.9°
CAXCASCBA110.7°109.5°
CAXCASH25109.2°109.4°
CAXCASH26109.2°109.5°
CAKCAJCAY118.9°118.4°
CAKCAJH14120.6°120.8°
CAJCAKH15120.2°120.4°
CASCBACAY119.2°119.7°
CBACASH25109.2°109.5°
CBACASH26109.2°109.5°
CBACAYCAJ119.3°119.0°
CBACAYCAC120.7°120.5°
CAJCAYCAC117.9°120.5°
CAYCAJH14120.5°120.8°
CAYCACCAD178.8°180.0°
CACCADCBD179.7°180.0°
CAOCAQNBC110.6°109.4°
CAQCAOCBB108.6°108.8°
CAOCAQH1109.2°109.5°
CAOCAQH2109.2°109.5°
CAQCAOH3109.7°109.6°
CAQCAOH4109.7°109.6°
CAQNBCCAT109.3°111.1°
CAQNBCCAR109.5°111.1°
NBCCAQH1109.2°109.5°
NBCCAQH2109.2°109.5°
CAOCBBCBD109.4°108.7°
CAOCBBCAP108.0°108.6°
CBBCAOH3109.7°109.6°
CBBCAOH4109.7°109.6°
CAOCBBH5110.3°110.1°
CADCBDCAT109.9°109.6°
CADCBDCBB109.8°109.6°
CADCBDOAB109.4°109.7°
CATNBCCAR109.5°110.9°
NBCCATCBD110.7°109.4°
NBCCATH11109.2°109.5°
NBCCATH12109.2°109.5°
NBCCARCAP110.9°109.3°
NBCCARH8109.1°109.5°
NBCCARH9109.1°109.5°
CATCBDCBB108.6°108.8°
CATCBDOAB109.7°109.5°
CBDCATH11109.2°109.5°
CBDCATH12109.1°109.5°
CBBCBDOAB109.5°109.6°
CBDCBBCAP108.5°108.6°
CBDCBBH5110.3°110.7°
CBDOABH13109.5°114.0°
CBBCAPCAR108.4°108.9°
CAPCBBH5110.3°110.1°
CBBCAPH6109.7°109.6°
CBBCAPH7109.7°109.6°
CARCAPH6109.7°109.6°
CARCAPH7109.7°109.7°
CAPCARH8109.1°109.5°
CAPCARH9109.1°109.5°
H1CAQH2109.5°109.5°
H3CAOH4109.4°109.7°
H6CAPH7109.5°109.6°
H8CARH9109.4°109.5°
H11CATH12109.4°109.5°
H16CANH17109.5°109.5°
H18CALH19109.4°109.4°
H20CAMH21109.5°109.4°
H22CAAH23109.5°109.5°
H22CAAH24109.4°109.4°
H23CAAH24109.5°109.5°
H25CASH26109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAAOAVCAMCAL175.9°180.0°
CAAOAVCAMH2056.1°59.9°
CAAOAVCAMH2164.2°59.9°
OAVCAAH22H23120.0°120.1°
OAVCAAH22H24120.0°119.9°
OAVCAAH23H24120.0°120.0°
OAVCAMCALH20119.8°120.0°
OAVCAMCALH21119.8°120.0°
OAVCAMCALCAN178.7°180.0°
OAVCAMCALH1858.4°60.0°
OAVCAMCALH1961.0°60.0°
OAVCAMH20H21120.4°119.9°
CAMOAVCAAH22180.0°180.0°
CAMOAVCAAH2360.0°60.0°
CAMOAVCAAH2460.0°60.0°
CAMCALCANH18120.2°120.1°
CAMCALCANH19120.2°120.0°
CAMCALCANOAW178.0°180.0°
CAMCALCANH1658.4°60.0°
CAMCALCANH1762.5°60.0°
CAMCALH18H19119.3°120.0°
CALCAMH20H21120.4°120.0°
CALCANOAWH16119.6°120.0°
CALCANOAWH17119.6°120.0°
CALCANOAWCAZ173.3°180.0°
CALCANH16H17121.2°120.0°
CANCALH18H19119.3°120.0°
CANCALCAMH2061.4°59.9°
CANCALCAMH2158.9°60.0°
CANOAWCAZNAU11.3°0.0°
CANOAWCAZCAK177.5°179.7°
OAWCANH16H17121.3°120.0°
OAWCANCALH1861.8°59.9°
OAWCANCALH1957.7°60.0°
OAWCAZNAUCAK170.9°179.7°
OAWCAZNAUCBA170.3°180.0°
OAWCAZCAKCAJ170.4°179.7°
OAWCAZCAKH159.6°0.2°
CAZOAWCANH1653.7°60.0°
CAZOAWCANH1767.1°60.0°
CAECAGCAIH30180.0°179.7°
CAGCAECAFH29180.0°180.0°
CAECAGCAICAX0.3°0.6°
CAGCAECAFCAH0.0°0.0°
CAGCAECAFH28180.0°180.0°
CAECAGCAIH31179.7°180.0°
CAICAGCAECAF0.2°0.3°
CAGCAICAXH31180.0°179.4°
CAGCAICAXCAH0.2°0.6°
CAGCAICAXCAS171.4°179.7°
CAICAGCAEH29179.8°179.7°
CAECAFCAHH28180.0°180.0°
CAECAFCAHCAX0.1°0.0°
CAECAFCAHH27179.9°179.9°
CAFCAECAGH30179.7°180.0°
NAUCAZCAKCAJ0.9°0.0°
CAZNAUCBACAS165.5°179.9°
CAZNAUCBACAY1.6°0.6°
NAUCAZCAKH15179.2°180.0°
CAKCAZNAUCBA0.6°0.3°
CAZCAKCAJH15180.0°180.0°
CAZCAKCAJCAY1.1°0.0°
CAZCAKCAJH14178.9°180.0°
CAICAXCAHCAF0.0°0.3°
CAICAXCAHCAS171.5°179.7°
CAICAXCASCBA122.2°90.3°
CAICAXCASH252.0°149.7°
CAICAXCASH26117.6°29.8°
CAICAXCAHH27179.9°179.8°
CAXCAICAGH30179.6°179.7°
NAUCBACASCAX68.6°90.0°
NAUCBACASCAY167.2°179.5°
NAUCBACAYCAJ3.5°0.6°
NAUCBACAYCAC159.5°179.7°
NAUCBACASH2551.6°150.0°
NAUCBACASH26171.2°30.1°
CAFCAHCAXH27180.0°179.9°
CAFCAHCAXCAS171.5°179.9°
CAHCAFCAEH29180.0°180.0°
CAHCAXCASCBA66.3°90.0°
CAHCAXCASH25173.5°30.0°
CAHCAXCASH2653.9°150.0°
CAXCAHCAFH28179.9°180.0°
CAHCAXCAIH31179.8°180.0°
CAXCASCBAH25120.2°120.0°
CAXCASCBAH26120.2°120.1°
CAXCASCBACAY124.2°90.5°
CAXCASH25H26119.4°120.0°
CASCAXCAHH278.5°0.0°
CASCAXCAIH318.7°0.2°
CAKCAJCAYCBA3.2°0.3°
CAKCAJCAYH14180.0°180.0°
CAKCAJCAYCAC160.3°180.0°
CASCBACAYCAJ163.6°179.9°
CASCBACAYCAC33.4°0.2°
CBACASH25H26119.4°120.0°
CBACAYCAJCAC163.5°179.7°
CBACAYCACCAD149.7°157.0°
CBACAYCAJH14176.8°179.7°
CAYCBACASH25115.6°29.5°
CAYCBACASH264.0°149.4°
CAJCAYCACCAD13.5°23.3°
CAYCAJCAKH15178.9°179.9°
CAYCACCADCBD39.0°3.7°
CACCAYCAJH1419.7°0.1°
CACCADCBDCAT168.3°160.4°
CACCADCBDCBB72.3°80.3°
CACCADCBDOAB47.8°40.1°
CAOCAQNBCH1120.2°120.0°
CAOCAQNBCH2120.2°120.0°
CAQCAOCBBH3119.9°119.8°
CAQCAOCBBH4119.9°119.8°
CAOCAQNBCCAT65.8°62.0°
CAOCAQNBCCAR54.1°62.0°
CAQCAOCBBCBD53.0°59.0°
CAQCAOCBBCAP64.9°59.0°
CAOCAQH1H2119.5°120.0°
CAQCAOH3H4120.4°120.3°
CAQCAOCBBH5174.5°179.6°
NBCCAQCAOCBB9.5°0.0°
CAQNBCCATCAR120.0°124.0°
CAQNBCCATCBD55.7°61.9°
CAQNBCCARCAP64.7°61.9°
NBCCAQH1H2119.5°120.0°
NBCCAQCAOH3110.4°119.8°
NBCCAQCAOH4129.4°119.8°
CAQNBCCARH8175.1°58.0°
CAQNBCCARH955.6°178.1°
CAQNBCCATH1164.6°58.0°
CAQNBCCATH12175.9°178.1°
CAOCBBCBDCAD57.4°60.7°
CAOCBBCBDCAT62.7°59.0°
CAOCBBCBDCAP117.6°118.0°
CAOCBBCBDH5121.5°121.1°
CAOCBBCBDOAB177.6°178.8°
CAOCBBCAPH5120.6°120.6°
CAOCBBCAPCAR54.8°59.0°
CBBCAOCAQH1110.7°119.9°
CBBCAOCAQH2129.6°120.0°
CBBCAOH3H4120.5°120.4°
CAOCBBCAPH665.1°60.8°
CAOCBBCAPH7174.6°179.0°
CADCBDCATNBC112.7°119.7°
CADCBDCATCBB120.1°119.8°
CADCBDCATOAB120.3°120.4°
CADCBDCBBOAB120.2°120.4°
CADCBDCBBCAP175.1°178.7°
CADCBDCBBH564.0°60.3°
CADCBDCATH117.5°0.2°
CADCBDCATH12127.1°120.3°
CADCBDOABH13180.0°60.3°
NBCCATCBDH11120.2°119.9°
NBCCATCBDH12120.2°120.0°
NBCCATCBDCBB7.4°0.1°
NBCCATCBDOAB127.0°119.9°
CATNBCCARCAP55.2°62.1°
CATNBCCAQH154.3°58.0°
CATNBCCAQH2174.0°178.1°
CATNBCCARH865.1°177.9°
CATNBCCARH9175.4°57.8°
NBCCATH11H12119.4°120.1°
CARNBCCATCBD64.3°62.1°
NBCCARCAPCBB7.9°0.1°
NBCCARCAPH8120.2°119.9°
NBCCARCAPH9120.2°120.0°
CARNBCCAQH1174.3°178.0°
CARNBCCAQH266.1°58.0°
NBCCARCAPH6127.8°119.7°
NBCCARCAPH7111.9°120.0°
NBCCARH8H9119.3°120.1°
CARNBCCATH11175.5°177.9°
CARNBCCATH1255.9°57.9°
CATCBDCBBOAB119.7°119.8°
CATCBDCBBCAP54.9°58.9°
CATCBDCBBH5175.8°179.9°
CBDCATH11H12119.4°120.1°
CATCBDOABH1359.4°60.0°
CBDCBBCAPH5120.9°121.4°
CBDCBBCAPCAR63.7°59.0°
CBDCBBCAOH3172.9°178.7°
CBDCBBCAOH466.8°60.8°
CBDCBBCAPH6176.4°178.8°
CBDCBBCAPH756.1°61.0°
CBBCBDCATH11127.6°120.0°
CBBCBDCATH12112.8°119.9°
CBBCBDOABH1359.6°179.4°
OABCBDCBBCAP64.8°60.8°
OABCBDCBBH556.1°60.1°
OABCBDCATH11112.8°120.2°
OABCBDCATH126.8°0.1°
CBBCAPCARH6119.8°119.8°
CBBCAPCARH7119.8°119.9°
CAPCBBCAOH354.9°60.8°
CAPCBBCAOH4175.2°178.8°
CBBCAPH6H7120.5°120.3°
CBBCAPCARH8128.2°120.0°
CBBCAPCARH9112.3°119.9°
CARCAPCBBH5175.4°179.6°
CARCAPH6H7120.5°120.4°
CAPCARH8H9119.4°120.1°
H1CAQCAOH3129.4°120.2°
H1CAQCAOH49.2°0.1°
H2CAQCAOH39.7°0.2°
H2CAQCAOH4110.5°120.2°
H3CAOCBBH565.7°59.8°
H4CAOCBBH554.6°60.7°
H5CBBCAPH655.5°59.9°
H5CBBCAPH764.8°60.4°
H6CAPCARH8112.0°0.2°
H6CAPCARH97.6°120.3°
H7CAPCARH88.3°120.1°
H7CAPCARH9127.9°0.0°
H14CAJCAKH151.1°0.0°
H16CANCALH18178.6°179.9°
H16CANCALH1961.9°60.0°
H17CANCALH1857.8°60.0°
H17CANCALH19177.3°180.0°
H18CALCAMH20178.3°180.0°
H18CALCAMH2161.4°60.1°
H19CALCAMH2058.8°60.0°
H19CALCAMH21179.1°180.0°
H22CAAH23H24120.0°120.0°
H27CAHCAFH280.1°0.1°
H28CAFCAEH290.0°0.0°
H29CAECAGH300.3°0.0°
H30CAGCAIH310.4°0.3°

224931

PDB entries from 2024-09-11

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