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T57

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
OADCBMdoub1.21Å1.26Å
OAICBJdoub1.21Å1.26Å
OACCBLdoub1.21Å1.27Å
CBJOAAsing1.34Å1.25Å
CBJCAZsing1.51Å1.56Å
CBMOALsing1.34Å1.26Å
CBMCBUsing1.51Å1.53Å
CBLOAKsing1.34Å1.26Å
CBLCBTsing1.51Å1.54Å
CAZCBCsing1.53Å1.54Å
CBCCBUsing1.53Å1.57Å
CBUNBHsing1.47Å1.48Å
CBTCBDsing1.53Å1.54Å
CBTNBGsing1.46Å1.49Å
CBDCBAsing1.53Å1.53Å
OAMPBVdoub1.48Å1.57Å
CBCAVsing1.53Å1.56Å
CBCAsing1.53Å1.53Å
NBHPBVsing1.68Å1.72Å
OAECBNdoub1.21Å1.24Å
CAVCAXsing1.53Å1.55Å
CAXOBIsing1.43Å1.42Å
NBGCBNsing1.35Å1.35Å
NCAsing1.47Å1.48Å
NCBOsing1.35Å1.33Å
CBACBOsing1.51Å1.54Å
CBNCAYsing1.51Å1.55Å
PBVOBIsing1.61Å1.58Å
PBVOAHsing1.61Å1.48Å
CACsing1.51Å1.56Å
CBOOAFdoub1.21Å1.23Å
CAYCAUsing1.53Å1.53Å
COdoub1.21Å1.26Å
COXTsing1.34Å1.25Å
CAUCASsing1.53Å1.53Å
CASCATsing1.53Å1.54Å
CATCAWsing1.53Å1.53Å
CAWNBEsing1.47Å1.48Å
NBECBPsing1.35Å1.34Å
CAQCAOdoub1.38Å1.40ÅAromatic
CAQCBRsing1.40Å1.39ÅAromatic
CAOCBQsing1.39Å1.39ÅAromatic
CBPCBRsing1.48Å1.40Å
CBPOAGdoub1.22Å1.23Å
CBRCARdoub1.40Å1.39ÅAromatic
CBQFANsing1.35Å1.46Å
CBQCAPdoub1.39Å1.40ÅAromatic
CARCAPsing1.38Å1.40ÅAromatic
OAAH1sing0.97Å0.95Å
CAZH2sing1.09Å1.10Å
CAZH3sing1.09Å1.10Å
CBCH4sing1.09Å1.10Å
CBCH5sing1.09Å1.10Å
CBUH6sing1.09Å1.10Å
OALH7sing0.97Å0.95Å
NBHH8sing1.01Å1.00Å
OAHH9sing0.97Å0.95Å
CAXH10sing1.09Å1.10Å
CAXH11sing1.09Å1.10Å
CAVH12sing1.09Å1.10Å
CAVH13sing1.09Å1.10Å
CBH14sing1.09Å1.10Å
CBH15sing1.09Å1.10Å
CAH16sing1.09Å1.10Å
OXTH17sing0.97Å0.95Å
NH18sing0.97Å1.00Å
CBAH19sing1.09Å1.10Å
CBAH20sing1.09Å1.10Å
CBDH21sing1.09Å1.10Å
CBDH22sing1.09Å1.10Å
CBTH23sing1.09Å1.10Å
OAKH24sing0.97Å0.95Å
NBGH25sing0.97Å1.00Å
CAYH26sing1.09Å1.10Å
CAYH27sing1.09Å1.10Å
CAUH28sing1.09Å1.10Å
CAUH29sing1.09Å1.10Å
CASH30sing1.09Å1.10Å
CASH31sing1.09Å1.10Å
CATH32sing1.09Å1.10Å
CATH33sing1.09Å1.10Å
CAWH34sing1.09Å1.10Å
CAWH35sing1.09Å1.10Å
NBEH36sing0.97Å1.00Å
CAQH37sing1.08Å1.08Å
CAOH38sing1.08Å1.08Å
CAPH39sing1.08Å1.08Å
CARH40sing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
OADCBMOAL126.1°120.0°
OADCBMCBU115.7°120.0°
OAICBJOAA124.6°120.0°
OAICBJCAZ119.2°120.0°
OACCBLOAK125.8°120.0°
OACCBLCBT117.5°120.0°
OAACBJCAZ116.2°120.0°
CBJOAAH1109.5°117.0°
CBJCAZCBC113.1°109.5°
CBJCAZH2108.5°109.5°
CBJCAZH3108.6°109.5°
OALCBMCBU118.1°120.0°
CBMOALH7109.5°117.0°
CBMCBUCBC106.7°109.4°
CBMCBUNBH112.9°109.5°
CBMCBUH6108.0°109.5°
OAKCBLCBT116.6°120.0°
CBLOAKH24109.5°117.1°
CBLCBTCBD108.7°109.4°
CBLCBTNBG112.0°109.5°
CBLCBTH23108.2°109.5°
CAZCBCCBU109.1°109.4°
CBCCAZH2108.6°109.5°
CBCCAZH3108.5°109.5°
CAZCBCH4109.5°109.4°
CAZCBCH5109.6°109.5°
CBCCBUNBH113.0°109.5°
CBUCBCH4109.6°109.5°
CBUCBCH5109.6°109.5°
CBCCBUH6107.5°109.5°
CBUNBHPBV117.2°111.0°
NBHCBUH6108.6°109.5°
CBUNBHH8107.5°111.0°
CBDCBTNBG110.9°109.5°
CBTCBDCBA110.5°109.5°
CBTCBDH21109.2°109.5°
CBTCBDH22109.2°109.5°
CBDCBTH23108.2°109.4°
CBTNBGCBN121.0°120.0°
NBGCBTH23108.8°109.5°
CBTNBGH25119.5°120.0°
CBDCBACBO108.8°109.5°
CBDCBAH19109.7°109.4°
CBDCBAH20109.7°109.5°
CBACBDH21109.2°109.5°
CBACBDH22109.2°109.5°
OAMPBVNBH105.5°109.5°
OAMPBVOBI110.9°109.5°
OAMPBVOAH111.0°109.5°
CAVCBCA111.0°109.5°
CBCAVCAX110.5°109.5°
CBCAVH12109.2°109.5°
CBCAVH13109.2°109.4°
CAVCBH14109.1°109.5°
CAVCBH15109.1°109.4°
CBCAN109.1°109.5°
CBCAC109.2°109.5°
CACBH14109.1°109.5°
CACBH15109.1°109.5°
CBCAH16109.0°109.5°
NBHPBVOBI103.5°109.5°
NBHPBVOAH111.9°109.5°
PBVNBHH8107.5°111.0°
OAECBNNBG123.0°120.0°
OAECBNCAY120.2°120.0°
CAVCAXOBI108.3°109.5°
CAVCAXH10109.8°109.5°
CAVCAXH11109.8°109.5°
CAXCAVH12109.2°109.5°
CAXCAVH13109.2°109.5°
CAXOBIPBV121.7°123.0°
OBICAXH10109.8°109.5°
OBICAXH11109.8°109.4°
NBGCBNCAY116.8°120.0°
CBNNBGH25119.5°120.0°
CANCBO121.7°120.0°
NCAC111.2°109.4°
NCAH16109.7°109.4°
CANH18119.2°120.0°
NCBOCBA115.8°120.0°
NCBOOAF123.4°120.0°
CBONH18119.2°120.0°
CBACBOOAF120.8°120.0°
CBOCBAH19109.6°109.5°
CBOCBAH20109.7°109.5°
CBNCAYCAU113.8°109.5°
CBNCAYH26108.4°109.5°
CBNCAYH27108.4°109.5°
OBIPBVOAH113.6°109.4°
PBVOAHH9109.5°114.1°
CACO118.0°120.0°
CACOXT117.8°120.0°
CCAH16108.6°109.5°
CAYCAUCAS112.8°109.5°
CAUCAYH26108.4°109.4°
CAUCAYH27108.3°109.5°
CAYCAUH28108.7°109.4°
CAYCAUH29108.6°109.5°
OCOXT124.2°120.0°
COXTH17109.5°117.0°
CAUCASCAT113.2°109.5°
CASCAUH28108.6°109.5°
CASCAUH29108.6°109.5°
CAUCASH30108.6°109.4°
CAUCASH31108.5°109.5°
CASCATCAW104.7°109.5°
CATCASH30108.5°109.5°
CATCASH31108.5°109.5°
CASCATH32110.7°109.5°
CASCATH33110.6°109.4°
CATCAWNBE117.9°109.5°
CAWCATH32110.6°109.5°
CAWCATH33110.7°109.4°
CATCAWH34107.3°109.5°
CATCAWH35107.3°109.5°
CAWNBECBP119.2°120.0°
NBECAWH34107.3°109.4°
NBECAWH35107.3°109.4°
CAWNBEH36120.4°120.0°
NBECBPCBR113.9°120.0°
NBECBPOAG122.6°120.0°
CBPNBEH36120.4°120.0°
CAOCAQCBR120.8°119.9°
CAQCAOCBQ120.1°120.1°
CAOCAQH37119.6°120.0°
CAQCAOH38120.0°120.0°
CAQCBRCBP119.0°120.1°
CAQCBRCAR119.1°119.8°
CBRCAQH37119.6°120.1°
CAOCBQFAN118.9°119.8°
CAOCBQCAP119.3°120.2°
CBQCAOH38119.9°119.9°
CBRCBPOAG123.5°120.1°
CBPCBRCAR121.8°120.1°
CBRCARCAP120.4°119.9°
CBRCARH40119.8°120.1°
FANCBQCAP121.8°119.9°
CBQCAPCAR120.2°120.1°
CBQCAPH39119.9°119.9°
CARCAPH39119.9°119.9°
CAPCARH40119.8°120.1°
H2CAZH3109.5°109.4°
H4CBCH5109.5°109.5°
H10CAXH11109.4°109.5°
H12CAVH13109.4°109.5°
H14CBH15109.5°109.5°
H19CBAH20109.4°109.5°
H21CBDH22109.5°109.5°
H26CAYH27109.5°109.4°
H28CAUH29109.5°109.4°
H30CASH31109.5°109.4°
H32CATH33109.5°109.4°
H34CAWH35109.5°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
OADCBMOALCBU177.2°180.0°
OADCBMCBUCBC77.3°120.0°
OADCBMCBUNBH158.0°0.0°
OADCBMCBUH638.0°120.0°
OADCBMOALH70.0°0.1°
OAICBJOAACAZ179.2°180.0°
OAICBJCAZCBC17.4°0.0°
OAICBJOAAH10.0°0.0°
OAICBJCAZH2103.2°120.0°
OAICBJCAZH3137.9°120.0°
OACCBLOAKCBT177.5°179.9°
OACCBLCBTCBD53.0°120.0°
OACCBLCBTNBG175.9°0.0°
OACCBLCBTH2364.2°120.0°
OACCBLOAKH240.0°0.1°
OAACBJCAZCBC161.9°180.0°
OAACBJCAZH277.6°60.0°
OAACBJCAZH341.3°60.0°
CBJCAZCBCH2120.5°120.0°
CBJCAZCBCH3120.6°120.0°
CBJCAZCBCCBU171.6°180.0°
CAZCBJOAAH1179.1°180.0°
CBJCAZH2H3118.3°120.0°
CBJCAZCBCH468.4°60.0°
CBJCAZCBCH551.7°60.0°
OALCBMCBUCBC100.1°60.0°
OALCBMCBUNBH24.5°180.0°
OALCBMCBUH6144.6°60.0°
CBMCBUCBCCAZ68.5°175.0°
CBMCBUCBCNBH124.6°119.9°
CBMCBUCBCH6115.6°120.0°
CBMCBUNBHH6119.7°120.0°
CBMCBUNBHPBV75.8°95.0°
CBMCBUCBCH4171.6°55.0°
CBMCBUCBCH551.5°65.0°
CBUCBMOALH7177.1°180.0°
CBMCBUNBHH845.3°28.9°
OAKCBLCBTCBD124.8°60.0°
OAKCBLCBTNBG1.9°179.9°
OAKCBLCBTH23118.0°59.9°
CBLCBTCBDNBG123.5°120.0°
CBLCBTCBDH23117.2°120.0°
CBLCBTNBGH23119.5°120.1°
CBLCBTCBDCBA163.1°175.0°
CBLCBTNBGCBN93.6°85.0°
CBLCBTCBDH2176.8°55.0°
CBLCBTCBDH2242.9°65.0°
CBTCBLOAKH24177.5°180.0°
CBLCBTNBGH2586.4°95.0°
CAZCBCCBUH4119.9°120.0°
CAZCBCCBUH5119.9°120.0°
CAZCBCCBUNBH56.2°65.1°
CBCCAZH2H3118.3°120.0°
CAZCBCH4H5120.2°120.0°
CAZCBCCBUH6176.0°55.0°
CBCCBUNBHH6119.2°120.1°
CBCCBUNBHPBV163.1°145.0°
CBUCBCCAZH251.1°60.0°
CBUCBCCAZH367.8°60.0°
CBUCBCH4H5120.2°120.0°
CBCCBUNBHH875.8°91.0°
CBUNBHPBVOAM19.5°180.0°
CBUNBHPBVH8121.1°124.0°
CBUNBHPBVOBI136.0°60.0°
CBUNBHPBVOAH101.3°60.0°
NBHCBUCBCH463.7°175.0°
NBHCBUCBCH5176.1°55.0°
CBDCBTNBGH23118.9°120.0°
CBTCBDCBAH21120.1°120.0°
CBTCBDCBAH22120.1°120.0°
CBDCBTNBGCBN144.8°155.0°
CBTCBDCBACBO166.1°180.0°
CBTCBDCBAH1973.9°60.0°
CBTCBDCBAH2046.2°60.0°
CBTCBDH21H22119.6°120.0°
CBDCBTNBGH2535.1°25.0°
NBGCBTCBDCBA73.4°65.0°
CBTNBGCBNOAE2.3°0.0°
CBTNBGCBNH25180.0°180.0°
CBTNBGCBNCAY179.4°180.0°
NBGCBTCBDH2146.7°175.0°
NBGCBTCBDH22166.5°55.0°
CBDCBACBON85.5°180.0°
CBDCBACBOH19119.9°120.0°
CBDCBACBOH20119.9°120.0°
CBDCBACBOOAF96.7°0.0°
CBDCBAH19H20120.3°120.0°
CBACBDH21H22119.5°120.0°
CBACBDCBTH2345.9°55.0°
OAMPBVNBHOBI116.6°120.0°
OAMPBVNBHOAH120.8°120.0°
OAMPBVOBICAX58.6°49.9°
OAMPBVOBIOAH125.8°120.0°
OAMPBVNBHH8101.6°56.1°
OAMPBVOAHH90.0°180.0°
CAVCBCAH14120.2°120.0°
CAVCBCAH15120.2°119.9°
CBCAVCAXH12120.2°120.0°
CBCAVCAXH13120.2°119.9°
CBCAVCAXOBI161.6°180.0°
CAVCBCAN162.1°65.0°
CAVCBCAC40.4°175.0°
CBCAVCAXH1041.8°60.0°
CBCAVCAXH1178.5°60.0°
CBCAVH12H13119.5°120.0°
CAVCBH14H15119.3°120.0°
CAVCBCAH1678.1°55.0°
CACBCAVCAX85.9°180.0°
CBCANC120.5°120.0°
CBCANH16119.4°120.0°
CBCANCBO173.7°155.0°
CBCACH16118.8°120.0°
CBCACO90.6°120.0°
CBCACOXT88.6°60.0°
CACBCAVH12153.9°60.0°
CACBCAVH1334.3°60.0°
CACBH14H15119.3°120.0°
CBCANH186.4°25.0°
NBHPBVOBICAX54.1°70.1°
NBHPBVOBIOAH121.5°120.0°
PBVNBHCBUH643.9°25.0°
NBHPBVOAHH9117.5°60.0°
OAECBNNBGCAY177.1°180.0°
OAECBNCAYCAU127.8°0.0°
OAECBNNBGH25177.7°180.0°
OAECBNCAYH267.1°120.0°
OAECBNCAYH27111.6°120.0°
CAVCAXOBIH10119.8°120.0°
CAVCAXOBIH11119.8°120.0°
CAVCAXOBIPBV113.8°180.0°
CAVCAXH10H11120.5°120.0°
CAXCAVH12H13119.5°120.0°
CAXCAVCBH14153.9°60.0°
CAXCAVCBH1534.3°60.0°
CAXOBIPBVOAH175.6°169.9°
OBICAXH10H11120.5°120.0°
OBICAXCAVH1278.2°60.0°
OBICAXCAVH1341.5°60.1°
NBGCBNCAYCAU55.0°180.0°
CBNNBGCBTH2325.9°35.0°
NBGCBNCAYH26175.7°60.0°
NBGCBNCAYH2765.6°60.0°
CANCBOH18180.0°180.0°
CANCBOCBA177.6°180.0°
NCACH16120.8°119.9°
CANCBOOAF0.2°0.1°
NCACO29.9°0.0°
NCACOXT151.0°180.0°
NCACBH1441.9°175.0°
NCACBH1577.7°55.0°
NCBOCBAOAF177.8°179.9°
CBONCAC65.9°85.0°
CBONCAH1654.3°34.9°
NCBOCBAH1934.4°60.0°
NCBOCBAH20154.6°60.0°
CBACBONH182.3°0.0°
CBOCBAH19H20120.3°120.0°
CBOCBACBDH2146.0°60.0°
CBOCBACBDH2273.7°60.0°
CBNCAYCAUH26120.7°120.0°
CBNCAYCAUH27120.6°120.1°
CBNCAYCAUCAS70.4°180.0°
CAYCBNNBGH250.6°0.0°
CBNCAYH26H27118.0°120.1°
CBNCAYCAUH28169.1°60.0°
CBNCAYCAUH2950.1°59.9°
OBIPBVNBHH814.9°176.1°
OBIPBVOAHH9125.7°60.0°
PBVOBICAXH10126.4°59.9°
PBVOBICAXH116.0°60.0°
OAHPBVNBHH8137.6°64.0°
CACOOXT179.1°180.0°
CCACBH1479.8°55.0°
CCACBH15160.6°65.0°
CACOXTH17179.1°180.0°
CCANH18114.1°95.0°
OAFCBONH18179.9°180.0°
OAFCBOCBAH19143.4°120.0°
OAFCBOCBAH2023.2°120.0°
CAYCAUCASH28120.5°119.9°
CAYCAUCASH29120.5°120.1°
CAYCAUCASCAT68.7°180.0°
CAUCAYH26H27118.0°120.0°
CAYCAUH28H29118.5°120.0°
CAYCAUCASH30170.8°60.0°
CAYCAUCASH3151.9°59.9°
OCCAH16150.6°120.0°
OCOXTH170.0°0.0°
OXTCCAH1630.2°60.0°
CAUCASCATH30120.6°120.0°
CAUCASCATH31120.5°120.0°
CAUCASCATCAW175.7°180.0°
CASCAUCAYH2650.3°60.0°
CASCAUCAYH27169.0°59.9°
CASCAUH28H29118.5°120.0°
CAUCASH30H31118.3°119.9°
CAUCASCATH3265.0°60.0°
CAUCASCATH3356.5°60.0°
CASCATCAWH32119.3°120.1°
CASCATCAWH33119.2°120.0°
CASCATCAWNBE170.7°180.0°
CATCASCAUH2851.9°60.0°
CATCASCAUH29170.8°60.0°
CATCASH30H31118.3°120.0°
CASCATH32H33122.2°120.0°
CASCATCAWH3468.2°60.0°
CASCATCAWH3549.5°60.0°
CATCAWNBEH34121.2°120.1°
CATCAWNBEH35121.2°120.0°
CATCAWNBECBP125.8°180.0°
CAWCATCASH3055.1°59.9°
CAWCATCASH3163.8°60.0°
CAWCATH32H33122.2°120.0°
CATCAWH34H35116.2°120.0°
CATCAWNBEH3654.1°0.0°
CAWNBECBPH36180.0°180.0°
CAWNBECBPCBR174.3°180.0°
CAWNBECBPOAG5.8°0.1°
NBECAWCATH3251.4°59.9°
NBECAWCATH3370.1°60.0°
NBECAWH34H35116.2°119.9°
NBECBPCBRCAQ37.1°0.2°
NBECBPCBROAG179.9°179.9°
NBECBPCBRCAR139.7°179.9°
CBPNBECAWH344.6°59.9°
CBPNBECAWH35113.0°60.0°
CAOCAQCBRH37180.0°180.0°
CAQCAOCBQH38180.0°180.0°
CAOCAQCBRCBP179.1°180.0°
CAOCAQCBRCAR2.2°0.2°
CAQCAOCBQFAN179.4°180.0°
CAQCAOCBQCAP0.5°0.1°
CBRCAQCAOCBQ1.4°0.1°
CAQCBRCBPCAR176.8°179.8°
CAQCBRCBPOAG142.7°179.8°
CAQCBRCARCAP2.1°0.5°
CBRCAQCAOH38178.6°179.9°
CAQCBRCARH40177.9°179.7°
CAOCBQFANCAP180.0°179.9°
CAOCBQCAPCAR0.5°0.2°
CBQCAOCAQH37178.6°179.9°
CAOCBQCAPH39179.6°180.0°
CBPCBRCARCAP178.9°179.7°
CBRCBPNBEH365.7°0.0°
CBPCBRCAQH370.9°0.0°
CBPCBRCARH401.1°0.1°
OAGCBPCBRCAR40.5°0.0°
OAGCBPNBEH36174.1°179.9°
CBRCARCAPCBQ1.3°0.5°
CBRCARCAPH40180.0°179.8°
CARCBRCAQH37177.8°179.8°
CBRCARCAPH39178.8°179.7°
FANCBQCAPCAR179.5°179.7°
FANCBQCAOH380.6°0.0°
FANCBQCAPH390.5°0.1°
CBQCAPCARH39180.0°179.8°
CAPCBQCAOH38179.5°179.9°
CBQCAPCARH40178.8°179.7°
H2CAZCBCH4171.1°180.0°
H2CAZCBCH568.8°60.0°
H3CAZCBCH452.2°60.0°
H3CAZCBCH5172.3°180.0°
H4CBCCBUH656.0°64.9°
H5CBCCBUH664.1°175.0°
H6CBUNBHH8165.0°148.9°
H10CAXCAVH12162.0°180.0°
H10CAXCAVH1378.4°60.0°
H11CAXCAVH1241.6°60.0°
H11CAXCAVH13161.3°180.0°
H12CAVCBH1433.7°180.0°
H12CAVCBH1585.8°60.0°
H13CAVCBH1485.9°60.0°
H13CAVCBH15154.5°NaN°
H14CBCAH16161.6°65.0°
H15CBCAH1642.1°175.0°
H16CANH18125.7°145.0°
H19CBACBDH21165.9°180.0°
H19CBACBDH2246.2°60.0°
H20CBACBDH2173.9°60.0°
H20CBACBDH22166.3°180.0°
H21CBDCBTH23166.0°65.0°
H22CBDCBTH2374.3°175.0°
H23CBTNBGH25154.0°145.0°
H26CAYCAUH2870.2°180.0°
H26CAYCAUH29170.8°60.1°
H27CAYCAUH2848.5°60.1°
H27CAYCAUH2970.5°180.0°
H28CAUCASH3068.7°179.9°
H28CAUCASH31172.4°60.0°
H29CAUCASH3050.3°60.1°
H29CAUCASH3168.6°180.0°
H30CASCATH32174.4°180.0°
H30CASCATH3364.1°60.0°
H31CASCATH3255.5°60.1°
H31CASCATH33177.0°180.0°
H32CATCAWH34172.6°180.0°
H32CATCAWH3569.8°60.0°
H33CATCAWH3451.1°60.0°
H33CATCAWH35168.7°180.0°
H34CAWNBEH36175.3°120.1°
H35CAWNBEH3667.1°120.0°
H37CAQCAOH381.4°0.1°
H39CAPCARH401.2°0.1°

221716

PDB entries from 2024-06-26

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