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7U2

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAEC6sing1.51Å1.55Å
CANOAOsing1.43Å1.40Å
CANC5sing1.50Å1.51Å
OAOCAPsing1.44Å1.43Å
C6C5doub1.39Å1.44ÅAromatic
C6N1sing1.32Å1.33ÅAromatic
C5C4sing1.38Å1.34ÅAromatic
N1C2doub1.33Å1.32ÅAromatic
CAPCAAsing1.53Å1.60Å
C4CAAsing1.50Å1.58Å
C4N3doub1.32Å1.37ÅAromatic
CAACAQsing1.54Å1.59Å
CAACBBsing1.54Å1.48Å
C2N3sing1.32Å1.32ÅAromatic
C2NAIsing1.38Å1.47Å
CAQNARsing1.49Å1.27Å
NAICAJsing1.47Å1.47Å
CBBCBAsing1.54Å1.34Å
NARCASsing1.47Å1.17Å
NARCBAsing1.49Å1.60Å
CASCATsing1.51Å1.56Å
CAJCAKsing1.53Å1.54Å
CALCAKsing1.53Å1.39Å
CALCAMsing1.53Å1.39Å
CAKCAMsing1.53Å1.39Å
CATCAZdoub1.38Å1.40ÅAromatic
CATCAUsing1.38Å1.39ÅAromatic
CAZCAYsing1.38Å1.39ÅAromatic
FAVCAUsing1.35Å1.37Å
CAUCAWdoub1.38Å1.39ÅAromatic
CAYCAXdoub1.38Å1.40ÅAromatic
CAWCAXsing1.38Å1.40ÅAromatic
CAEH1sing1.09Å1.10Å
CAEH2sing1.09Å1.10Å
CAEH3sing1.09Å1.10Å
CAJH4sing1.09Å1.10Å
CAJH5sing1.09Å1.10Å
CAKH6sing1.09Å1.10Å
CALH7sing1.09Å1.10Å
CALH8sing1.09Å1.10Å
CAMH9sing1.09Å1.10Å
CAMH10sing1.09Å1.10Å
CANH11sing1.09Å1.10Å
CANH12sing1.09Å1.10Å
CAPH13sing1.09Å1.10Å
CAPH14sing1.09Å1.10Å
CAQH15sing1.09Å1.10Å
CAQH16sing1.09Å1.10Å
CASH17sing1.09Å1.10Å
CASH18sing1.09Å1.10Å
CAWH19sing1.08Å1.08Å
CAXH20sing1.08Å1.08Å
CAYH21sing1.08Å1.08Å
CAZH22sing1.08Å1.08Å
CBAH23sing1.09Å1.10Å
CBAH24sing1.09Å1.10Å
CBBH25sing1.09Å1.10Å
CBBH26sing1.09Å1.10Å
NAIH27sing0.97Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAEC6C5120.7°120.4°
CAEC6N1120.2°120.4°
C6CAEH1109.5°109.5°
C6CAEH2109.5°109.5°
C6CAEH3109.5°109.5°
OAOCANC5112.0°110.3°
CANOAOCAP113.8°113.2°
OAOCANH11108.8°109.2°
OAOCANH12108.8°109.3°
CANC5C6122.8°119.7°
CANC5C4118.9°121.6°
C5CANH11108.8°109.4°
C5CANH12108.8°109.3°
OAOCAPCAA113.8°108.5°
OAOCAPH13108.4°109.5°
OAOCAPH14108.4°110.1°
C5C6N1119.2°119.2°
C6C5C4118.3°118.7°
C6N1C2120.5°120.7°
C5C4CAA119.9°121.0°
C5C4N3119.0°119.1°
N1C2N3121.7°121.5°
N1C2NAI120.0°119.2°
CAPCAAC4113.3°110.7°
CAPCAACAQ109.4°110.1°
CAPCAACBB105.9°110.1°
CAACAPH13108.4°109.6°
CAACAPH14108.4°109.5°
CAAC4N3121.1°119.9°
C4CAACAQ112.0°110.1°
C4CAACBB110.9°110.2°
C4N3C2121.3°120.8°
CAQCAACBB104.8°105.5°
CAACAQNAR106.4°104.5°
CAACAQH15110.2°110.4°
CAACAQH16110.2°110.4°
CAACBBCBA103.9°104.9°
CAACBBH25110.9°110.3°
CAACBBH26110.8°110.3°
N3C2NAI118.3°119.2°
C2NAICAJ119.0°120.0°
C2NAIH27107.1°120.0°
CAQNARCAS109.0°111.1°
CAQNARCBA106.3°104.3°
NARCAQH15110.2°110.4°
NARCAQH16110.2°110.5°
NAICAJCAK110.4°109.5°
NAICAJH4109.3°109.4°
NAICAJH5109.2°109.5°
CAJNAIH27107.0°120.0°
CBBCBANAR104.9°104.6°
CBBCBAH23110.6°110.4°
CBBCBAH24110.6°110.5°
CBACBBH25110.8°110.4°
CBACBBH26110.8°110.3°
CASNARCBA110.8°111.0°
NARCASCAT110.8°109.5°
NARCASH17109.1°109.4°
NARCASH18109.1°109.5°
NARCBAH23110.6°110.4°
NARCBAH24110.6°110.5°
CASCATCAZ120.0°120.0°
CASCATCAU120.0°120.0°
CATCASH17109.1°109.5°
CATCASH18109.1°109.5°
CAJCAKCAL149.9°117.5°
CAJCAKCAM150.0°117.5°
CAKCAJH4109.2°109.5°
CAKCAJH5109.2°109.5°
CAJCAKH690.2°115.6°
CAKCALCAM60.0°60.0°
CALCAKCAM60.1°60.0°
CALCAKH690.2°117.5°
CAKCALH7120.0°117.5°
CAKCALH8120.0°117.5°
CALCAMCAK59.9°60.0°
CAMCALH7120.0°117.5°
CAMCALH8120.0°117.5°
CALCAMH9120.0°117.5°
CALCAMH10120.0°117.5°
CAMCAKH690.2°117.5°
CAKCAMH9120.0°117.5°
CAKCAMH10120.0°117.5°
CAZCATCAU120.0°120.0°
CATCAZCAY120.0°120.0°
CATCAZH22120.0°120.0°
CATCAUFAV119.9°120.0°
CATCAUCAW120.1°120.0°
CAZCAYCAX119.9°120.0°
CAZCAYH21120.1°120.0°
CAYCAZH22120.0°120.0°
FAVCAUCAW120.0°120.0°
CAUCAWCAX119.9°120.0°
CAUCAWH19120.0°120.0°
CAYCAXCAW120.1°120.0°
CAYCAXH20120.0°120.0°
CAXCAYH21120.0°120.0°
CAXCAWH19120.0°120.0°
CAWCAXH20119.9°120.0°
H1CAEH2109.5°109.5°
H1CAEH3109.4°109.5°
H2CAEH3109.4°109.4°
H4CAJH5109.5°109.5°
H7CALH8109.5°115.6°
H9CAMH10109.5°115.5°
H11CANH12109.5°109.2°
H13CAPH14109.5°109.6°
H15CAQH16109.4°110.5°
H17CASH18109.5°109.5°
H23CBAH24109.4°110.4°
H25CBBH26109.5°110.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAEC6C5CAN0.0°0.4°
CAEC6C5N1180.0°180.0°
CAEC6C5C4179.8°179.8°
CAEC6N1C2180.0°180.0°
C6CAEH1H2120.0°120.0°
C6CAEH1H3120.0°120.1°
C6CAEH2H3120.0°120.0°
OAOCANC5H11120.4°120.2°
OAOCANC5H12120.4°120.2°
OAOCANC5C6141.5°163.5°
OAOCANC5C438.3°16.8°
CANOAOCAPCAA47.2°69.7°
OAOCANH11H12118.8°119.5°
CANOAOCAPH1373.4°170.7°
CANOAOCAPH14167.8°50.2°
C5CANOAOCAP63.4°52.0°
CANC5C6C4179.8°179.8°
CANC5C6N1180.0°179.6°
CANC5C4CAA0.5°0.5°
CANC5C4N3179.9°179.8°
C5CANH11H12118.9°119.6°
OAOCAPCAAH13120.6°119.5°
OAOCAPCAAH14120.6°120.2°
OAOCAPCAAC48.1°48.0°
OAOCAPCAACAQ133.8°170.0°
OAOCAPCAACBB113.7°74.2°
CAPOAOCANH11176.2°68.3°
CAPOAOCANH1257.0°172.3°
OAOCAPH13H14118.1°120.8°
C5C6N1C20.0°0.0°
C6C5C4CAA179.7°179.7°
C6C5C4N30.3°0.0°
C5C6CAEH1179.9°90.0°
C5C6CAEH260.0°150.0°
C5C6CAEH360.0°30.0°
C6C5CANH1121.1°76.3°
C6C5CANH1298.1°43.2°
N1C6C5C40.2°0.1°
C6N1C2N30.1°0.4°
C6N1C2NAI180.0°179.9°
N1C6CAEH10.0°90.0°
N1C6CAEH2120.0°30.0°
N1C6CAEH3120.0°149.9°
C5C4CAACAP14.9°16.2°
C5C4CAAN3179.3°179.7°
C5C4CAACAQ109.4°138.1°
C5C4CAACBB133.9°105.9°
C5C4N3C20.2°0.4°
C4C5CANH11158.7°103.5°
C4C5CANH1282.1°137.0°
N1C2N3C40.0°0.6°
N1C2N3NAI179.9°179.7°
N1C2NAICAJ163.0°0.0°
N1C2NAIH2741.6°180.0°
CAPCAAC4CAQ124.3°121.9°
CAPCAAC4CBB119.0°122.1°
CAPCAAC4N3165.8°164.2°
CAPCAACAQCBB113.2°118.8°
CAPCAACAQNAR114.7°95.1°
CAPCAACBBCBA140.6°118.8°
CAACAPH13H14118.0°120.2°
CAPCAACAQH15125.8°146.1°
CAPCAACAQH164.8°23.7°
CAPCAACBBH2521.4°0.0°
CAPCAACBBH26100.3°122.4°
C4CAACAQCBB120.4°118.9°
CAAC4N3C2179.6°179.9°
C4CAACAQNAR118.9°142.5°
C4CAACBBCBA96.1°118.8°
C4CAACAPH13112.5°167.5°
C4CAACAPH14128.8°72.3°
C4CAACAQH150.7°23.8°
C4CAACAQH16121.6°98.7°
C4CAACBBH25144.7°122.4°
C4CAACBBH2623.0°0.1°
N3C4CAACAQ70.0°42.2°
N3C4CAACBB46.8°73.8°
C4N3C2NAI179.8°179.7°
CAACAQNARH15119.5°118.7°
CAACAQNARH16119.5°118.8°
CAQCAACBBCBA24.9°0.1°
CAACAQNARCAS138.1°158.7°
CAACAQNARCBA18.7°39.1°
CAQCAACAPH1313.2°70.5°
CAQCAACAPH14105.6°49.7°
CAACAQH15H16121.4°122.4°
CAQCAACBBH2594.2°118.8°
CAQCAACBBH26144.0°118.9°
CBBCAACAQNAR1.5°23.6°
CAACBBCBAH25119.2°118.8°
CAACBBCBAH26119.1°118.8°
CAACBBCBANAR35.3°23.8°
CBBCAACAPH13125.7°45.3°
CBBCAACAPH146.9°165.6°
CBBCAACAQH15121.0°95.1°
CBBCAACAQH16118.0°142.4°
CAACBBCBAH23154.6°142.5°
CAACBBCBAH2484.0°95.1°
CAACBBH25H26122.6°122.2°
N3C2NAICAJ16.9°179.7°
N3C2NAIH27138.2°0.2°
C2NAICAJH27121.4°179.9°
C2NAICAJCAK103.8°180.0°
C2NAICAJH416.4°60.0°
C2NAICAJH5136.1°60.0°
CAQNARCBACBB36.6°39.2°
CAQNARCASCBA116.6°115.5°
CAQNARCASCAT162.8°170.0°
NARCAQH15H16121.4°122.5°
CAQNARCASH1777.0°50.0°
CAQNARCASH1842.6°69.9°
CAQNARCBAH23155.9°158.0°
CAQNARCBAH2482.7°79.7°
NAICAJCAKH4120.2°119.9°
NAICAJCAKH5120.1°120.0°
NAICAJCAKCAL4.3°116.4°
NAICAJCAKCAM177.1°175.0°
NAICAJH4H5119.6°120.0°
NAICAJCAKH686.4°29.4°
CBBCBANARCAS154.8°158.9°
CBBCBANARH23119.3°118.8°
CBBCBANARH24119.3°118.9°
CBBCBAH23H24122.1°122.4°
CBACBBH25H26122.6°122.3°
NARCASCATH17120.2°119.9°
NARCASCATH18120.2°120.1°
NARCASCATCAZ68.6°105.0°
NARCASCATCAU111.8°74.7°
CASNARCAQH1518.5°40.0°
CASNARCAQH16102.4°82.5°
NARCASH17H18119.4°120.0°
CASNARCBAH2385.9°82.4°
CASNARCBAH2435.5°40.0°
CBANARCASCAT80.6°74.5°
CBANARCAQH15100.9°79.6°
CBANARCAQH16138.2°157.9°
CBANARCASH1739.6°165.5°
CBANARCASH18159.2°45.5°
NARCBAH23H24122.1°122.4°
NARCBACBBH2583.8°95.1°
NARCBACBBH26154.4°142.6°
CASCATCAZCAU179.6°179.7°
CASCATCAZCAY179.8°179.7°
CASCATCAUFAV0.1°0.0°
CASCATCAUCAW179.8°180.0°
CATCASH17H18119.4°120.0°
CASCATCAZH220.2°0.0°
CAJCAKCALCAM179.2°107.5°
CAJCAKCALH690.7°145.1°
CAJCAKCAMH690.7°145.0°
CAKCAJH4H5119.6°120.0°
CAJCAKCALH769.7°0.0°
CAJCAKCALH871.4°145.0°
CAJCAKCAMH969.7°145.0°
CAJCAKCAMH1071.4°0.0°
CAKCAJNAIH27134.8°0.1°
CAKCALCAMH7109.5°107.5°
CAKCALCAMH8109.5°107.4°
CALCAKCAMH690.1°107.5°
CALCAKCAJH4124.5°3.6°
CALCAKCAJH5115.8°123.6°
CAKCALH7H8144.8°145.6°
CAKCALCAMH9109.4°107.5°
CAKCALCAMH10109.4°107.5°
CAMCALH7H8144.7°145.8°
CALCAMH9H10144.8°145.7°
CAMCAKCAJH456.9°65.0°
CAMCAKCAJH562.8°55.0°
CAKCAMH9H10144.7°145.7°
CATCAZCAYH22180.0°179.7°
CAZCATCAUFAV179.8°179.7°
CAZCATCAUCAW0.1°0.3°
CATCAZCAYCAX0.1°0.6°
CAZCATCASH17171.2°135.1°
CAZCATCASH1851.6°15.1°
CATCAZCAYH21179.9°179.7°
CAUCATCAZCAY0.2°0.6°
CATCAUFAVCAW179.9°180.0°
CATCAUCAWCAX0.0°0.0°
CAUCATCASH178.4°45.2°
CAUCATCASH18128.1°165.2°
CATCAUCAWH19180.0°180.0°
CAUCATCAZH22179.8°179.7°
CAZCAYCAXH21180.0°179.7°
CAZCAYCAXCAW0.0°0.3°
CAZCAYCAXH20180.0°179.7°
FAVCAUCAWCAX179.9°180.0°
FAVCAUCAWH190.1°0.0°
CAUCAWCAXCAY0.1°0.0°
CAUCAWCAXH19180.0°180.0°
CAUCAWCAXH20179.9°180.0°
CAYCAXCAWH20180.0°180.0°
CAYCAXCAWH19180.0°180.0°
CAXCAYCAZH22179.9°179.7°
CAWCAXCAYH21180.0°180.0°
H1CAEH2H3120.0°120.0°
H4CAJCAKH633.7°149.3°
H4CAJNAIH27105.0°120.0°
H5CAJCAKH6153.4°90.6°
H5CAJNAIH2714.7°120.0°
H6CAKCALH7160.4°145.1°
H6CAKCALH819.4°0.1°
H6CAKCAMH9160.4°0.0°
H6CAKCAMH1019.3°145.0°
H7CALCAMH90.0°145.0°
H7CALCAMH10141.1°0.0°
H8CALCAMH9141.1°0.1°
H8CALCAMH100.1°145.0°
H19CAWCAXH200.0°0.0°
H20CAXCAYH210.0°0.0°
H21CAYCAZH220.2°0.0°
H23CBACBBH2535.4°23.7°
H23CBACBBH2686.3°98.7°
H24CBACBBH25156.9°146.0°
H24CBACBBH2635.1°23.7°

222415

PDB entries from 2024-07-10

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