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0UN

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CARCATsing1.53Å1.50Å
CARNBNsing1.47Å1.44Å
CABNBNsing1.47Å1.45Å
CASNBNsing1.47Å1.44Å
CASCAUsing1.53Å1.50Å
CAUNBOsing1.47Å1.45Å
NBOCATsing1.47Å1.44Å
CBHNBOsing1.40Å1.35Å
CBHCAOsing1.39Å1.36ÅAromatic
CBKCAOdoub1.38Å1.36ÅAromatic
CBKOBAsing1.36Å1.31Å
CAAOBAsing1.43Å1.37Å
CAKCBHdoub1.39Å1.36ÅAromatic
CALCAKsing1.38Å1.36ÅAromatic
CALCBJdoub1.39Å1.35ÅAromatic
CBJCBKsing1.39Å1.33ÅAromatic
NAZCBJsing1.40Å1.27Å
C2NAZsing1.39Å1.29Å
N3C2doub1.33Å1.33ÅAromatic
N1C2sing1.32Å1.31ÅAromatic
C6N1doub1.32Å1.29ÅAromatic
C5C6sing1.38Å1.35ÅAromatic
C5C4doub1.40Å1.36ÅAromatic
CL5C5sing1.74Å1.68Å
C4N3sing1.33Å1.31ÅAromatic
OBBC4sing1.35Å1.33Å
OBBCBGsing1.36Å1.33Å
CBGCANsing1.39Å1.37ÅAromatic
CANCBFdoub1.39Å1.37ÅAromatic
CAJCBGdoub1.39Å1.36ÅAromatic
CAJCAHsing1.38Å1.37ÅAromatic
CAHCAIdoub1.38Å1.38ÅAromatic
CAICBFsing1.39Å1.37ÅAromatic
CBFNAYsing1.40Å1.31Å
NAYCBDsing1.35Å1.31Å
CBDCAQsing1.47Å1.53Å
OAECBDdoub1.22Å1.22Å
CAQCAPdoub1.33Å1.52Å
CATHATsing1.09Å1.10Å
CATHATAsing1.09Å1.10Å
CARHARsing1.09Å1.10Å
CARHARAsing1.09Å1.10Å
CABHABsing1.09Å1.10Å
CABHABAsing1.09Å1.10Å
CABHABBsing1.09Å1.10Å
CASHASsing1.09Å1.10Å
CASHASAsing1.09Å1.10Å
CAUHAUsing1.09Å1.10Å
CAUHAUAsing1.09Å1.10Å
CAOHAOsing1.08Å1.08Å
CAAHAAsing1.09Å1.10Å
CAAHAAAsing1.09Å1.10Å
CAAHAABsing1.09Å1.10Å
CAKHAKsing1.08Å1.08Å
CALHALsing1.08Å1.08Å
NAZHNAZsing0.97Å1.00Å
C6H6sing1.08Å1.08Å
CANHANsing1.08Å1.08Å
CAJHAJsing1.08Å1.08Å
CAHHAHsing1.08Å1.08Å
CAIHAIsing1.08Å1.08Å
NAYHNAYsing0.97Å1.00Å
CAQHAQsing1.08Å1.08Å
CAPHAPsing1.08Å1.08Å
CAPHAPAsing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CATCARNBN107.9°109.4°
CARCATNBO108.5°109.4°
CARCATHAT109.8°109.5°
CARCATHATA109.8°109.5°
CATCARHAR110.0°109.5°
CATCARHARA110.0°109.6°
CARNBNCAB107.9°111.0°
CARNBNCAS105.8°110.9°
NBNCARHAR110.0°109.4°
NBNCARHARA110.0°109.5°
CABNBNCAS106.9°111.0°
NBNCABHAB109.5°109.5°
NBNCABHABA109.5°109.5°
NBNCABHABB109.5°109.4°
NBNCASCAU107.0°109.4°
NBNCASHAS110.3°109.5°
NBNCASHASA110.3°109.5°
CASCAUNBO109.1°109.4°
CAUCASHAS110.3°109.4°
CAUCASHASA110.3°109.5°
CASCAUHAU109.6°109.5°
CASCAUHAUA109.6°109.4°
CAUNBOCAT122.2°110.9°
CAUNBOCBH118.3°111.0°
NBOCAUHAU109.6°109.5°
NBOCAUHAUA109.6°109.5°
CATNBOCBH119.4°111.0°
NBOCATHAT109.8°109.5°
NBOCATHATA109.8°109.5°
NBOCBHCAO120.2°120.0°
NBOCBHCAK118.8°120.0°
CBHCAOCBK118.3°119.9°
CAOCBHCAK120.9°120.0°
CBHCAOHAO120.8°120.0°
CAOCBKOBA122.5°120.0°
CAOCBKCBJ120.6°119.9°
CBKCAOHAO120.8°120.1°
CBKOBACAA101.5°117.0°
OBACBKCBJ116.9°120.0°
OBACAAHAA109.5°109.5°
OBACAAHAAA109.5°109.5°
OBACAAHAAB109.5°109.5°
CBHCAKCAL119.5°120.2°
CBHCAKHAK120.3°119.9°
CAKCALCBJ118.7°120.0°
CALCAKHAK120.2°119.9°
CAKCALHAL120.6°120.0°
CALCBJCBK121.9°120.0°
CALCBJNAZ122.1°120.0°
CBJCALHAL120.7°120.0°
CBKCBJNAZ116.0°120.0°
CBJNAZC2117.2°120.0°
CBJNAZHNAZ121.4°120.0°
NAZC2N3119.7°119.1°
NAZC2N1117.1°119.2°
C2NAZHNAZ121.4°120.0°
N3C2N1123.2°121.7°
C2N3C4118.4°120.6°
C2N1C6120.3°120.9°
N1C6C5118.1°119.3°
N1C6H6121.0°120.3°
C6C5C4121.6°118.5°
C6C5CL5118.3°120.8°
C5C6H6121.0°120.4°
C4C5CL5120.1°120.8°
C5C4N3118.4°119.1°
C5C4OBB118.9°120.5°
N3C4OBB122.7°120.5°
C4OBBCBG116.5°118.0°
OBBCBGCAN119.5°120.1°
OBBCBGCAJ121.4°120.0°
CBGCANCBF121.5°119.9°
CANCBGCAJ119.1°119.9°
CBGCANHAN119.2°120.1°
CANCBFCAI119.5°119.9°
CANCBFNAY117.2°120.0°
CBFCANHAN119.3°120.0°
CBGCAJCAH120.1°120.1°
CBGCAJHAJ120.0°119.9°
CAJCAHCAI120.8°120.1°
CAHCAJHAJ119.9°119.9°
CAJCAHHAH119.6°120.0°
CAHCAICBF119.1°120.0°
CAICAHHAH119.6°119.9°
CAHCAIHAI120.5°120.0°
CAICBFNAY123.3°120.0°
CBFCAIHAI120.4°120.0°
CBFNAYCBD123.3°120.0°
CBFNAYHNAY118.3°120.0°
NAYCBDCAQ114.2°120.0°
NAYCBDOAE124.1°120.0°
CBDNAYHNAY118.4°120.0°
CAQCBDOAE121.7°120.0°
CBDCAQCAP113.5°120.0°
CBDCAQHAQ123.3°120.0°
CAPCAQHAQ123.3°120.0°
CAQCAPHAP120.0°120.0°
CAQCAPHAPA120.0°120.0°
HATCATHATA109.1°109.5°
HARCARHARA108.9°109.5°
HABCABHABA109.5°109.5°
HABCABHABB109.5°109.4°
HABACABHABB109.5°109.5°
HASCASHASA108.7°109.5°
HAUCAUHAUA109.3°109.5°
HAACAAHAAA109.5°109.5°
HAACAAHAAB109.4°109.4°
HAAACAAHAAB109.5°109.4°
HAPCAPHAPA120.0°120.0°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CATCARNBNHAR120.0°120.0°
CATCARNBNHARA120.0°120.0°
CATCARNBNCAB172.0°176.8°
CATCARNBNCAS73.9°59.3°
CARCATNBOCAU38.5°59.3°
CARCATNBOHAT120.0°120.0°
CARCATNBOHATA120.0°120.0°
CARCATNBOCBH145.7°176.8°
CARCATHATHATA120.4°120.0°
CATCARHARHARA120.7°120.1°
CARNBNCABCAS113.4°123.8°
CARNBNCASCAU73.1°59.3°
NBNCARCATNBO53.2°58.4°
NBNCARCATHAT66.8°61.6°
NBNCARCATHATA173.3°178.4°
NBNCARHARHARA120.7°120.0°
CARNBNCABHAB180.0°59.9°
CARNBNCABHABA60.0°180.0°
CARNBNCABHABB60.0°60.0°
CARNBNCASHAS46.9°60.6°
CARNBNCASHASA166.9°179.3°
CABNBNCASCAU172.1°176.8°
CABNBNCARHAR67.9°63.2°
CABNBNCARHARA52.1°56.8°
NBNCABHABHABA120.0°120.0°
NBNCABHABHABB120.0°119.9°
NBNCABHABAHABB120.0°120.0°
CABNBNCASHAS67.9°63.2°
CABNBNCASHASA52.1°56.9°
NBNCASCAUHAS120.0°120.0°
NBNCASCAUHASA120.0°120.0°
NBNCASCAUNBO52.8°58.4°
CASNBNCARHAR46.1°60.7°
CASNBNCARHARA166.1°179.3°
CASNBNCABHAB66.6°176.3°
CASNBNCABHABA53.4°56.2°
CASNBNCABHABB173.4°63.8°
NBNCASHASHASA121.0°120.1°
NBNCASCAUHAU172.8°178.4°
NBNCASCAUHAUA67.2°61.6°
CASCAUNBOHAU120.0°120.0°
CASCAUNBOHAUA120.0°119.9°
CASCAUNBOCAT38.6°59.2°
CASCAUNBOCBH145.5°176.9°
CAUCASHASHASA121.0°120.0°
CASCAUHAUHAUA120.1°120.0°
CAUNBOCATCBH175.8°123.9°
CAUNBOCBHCAO179.7°180.0°
CAUNBOCBHCAK0.4°0.3°
CAUNBOCATHAT81.6°60.7°
CAUNBOCATHATA158.5°179.3°
NBOCAUCASHAS67.2°61.6°
NBOCAUCASHASA172.8°178.4°
NBOCAUHAUHAUA120.1°120.1°
CATNBOCBHCAO4.3°56.2°
CATNBOCBHCAK175.6°124.1°
NBOCATHATHATA120.4°120.0°
NBOCATCARHAR66.8°61.5°
NBOCATCARHARA173.2°178.4°
CATNBOCAUHAU158.6°179.3°
CATNBOCAUHAUA81.4°60.7°
NBOCBHCAOCAK179.9°179.7°
NBOCBHCAOCBK180.0°180.0°
NBOCBHCAKCAL180.0°180.0°
CBHNBOCATHAT94.3°63.2°
CBHNBOCATHATA25.7°56.8°
CBHNBOCAUHAU25.5°56.9°
CBHNBOCAUHAUA94.5°63.2°
NBOCBHCAOHAO0.0°0.1°
NBOCBHCAKHAK0.0°0.1°
CBHCAOCBKHAO180.0°180.0°
CBHCAOCBKOBA180.0°180.0°
CAOCBHCAKCAL0.1°0.3°
CBHCAOCBKCBJ0.1°0.0°
CAOCBHCAKHAK179.9°179.8°
CAOCBKOBACBJ180.0°180.0°
CAOCBKOBACAA35.9°0.0°
CBKCAOCBHCAK0.1°0.3°
CAOCBKCBJCAL0.0°0.3°
CAOCBKCBJNAZ179.9°180.0°
OBACBKCBJCAL180.0°179.7°
OBACBKCBJNAZ0.0°0.0°
OBACBKCAOHAO0.0°0.0°
CBKOBACAAHAA180.0°60.0°
CBKOBACAAHAAA60.0°60.0°
CBKOBACAAHAAB60.0°180.0°
CAAOBACBKCBJ144.1°180.0°
OBACAAHAAHAAA120.0°120.1°
OBACAAHAAHAAB120.0°120.0°
OBACAAHAAAHAAB120.0°120.0°
CBHCAKCALHAK180.0°179.9°
CBHCAKCALCBJ0.1°0.0°
CAKCBHCAOHAO179.9°179.8°
CBHCAKCALHAL179.9°180.0°
CAKCALCBJHAL180.0°179.9°
CAKCALCBJCBK0.0°0.3°
CAKCALCBJNAZ179.9°180.0°
CALCBJCBKNAZ180.0°179.7°
CALCBJNAZC226.9°34.7°
CBJCALCAKHAK179.9°180.0°
CALCBJNAZHNAZ153.2°145.3°
CBKCBJNAZC2153.2°145.0°
CBJCBKCAOHAO180.0°180.0°
CBKCBJCALHAL180.0°179.7°
CBKCBJNAZHNAZ26.8°35.0°
CBJNAZC2HNAZ180.0°179.9°
CBJNAZC2N31.5°175.9°
CBJNAZC2N1178.6°3.8°
NAZCBJCALHAL0.1°0.0°
NAZC2N3N1179.9°179.7°
NAZC2N1C6180.0°179.9°
NAZC2N3C4180.0°179.9°
N3C2N1C60.1°0.2°
C2N3C4C50.1°0.0°
C2N3C4OBB180.0°179.7°
N3C2NAZHNAZ178.5°4.2°
C2N1C6C50.1°0.1°
N1C2N3C40.1°0.3°
N1C2NAZHNAZ1.4°176.1°
C2N1C6H6179.9°180.0°
N1C6C5H6180.0°179.9°
N1C6C5C40.1°0.4°
N1C6C5CL5180.0°180.0°
C6C5C4CL5179.9°179.6°
C6C5C4N30.1°0.4°
C6C5C4OBB180.0°180.0°
C5C4N3OBB180.0°179.6°
C5C4OBBCBG169.1°174.9°
C4C5C6H6179.9°179.7°
CL5C5C4N3180.0°180.0°
CL5C5C4OBB0.0°0.4°
CL5C5C6H60.0°0.1°
N3C4OBBCBG10.9°5.5°
C4OBBCBGCAN70.9°65.8°
C4OBBCBGCAJ109.1°114.5°
OBBCBGCANCAJ180.0°179.7°
OBBCBGCANCBF180.0°179.9°
OBBCBGCAJCAH180.0°179.9°
OBBCBGCANHAN0.0°0.0°
OBBCBGCAJHAJ0.0°0.0°
CBGCANCBFHAN180.0°180.0°
CANCBGCAJCAH0.0°0.2°
CBGCANCBFCAI0.0°0.0°
CBGCANCBFNAY180.0°180.0°
CANCBGCAJHAJ180.0°179.7°
CBFCANCBGCAJ0.0°0.2°
CANCBFCAICAH0.0°0.3°
CANCBFCAINAY180.0°180.0°
CANCBFNAYCBD168.1°34.6°
CANCBFCAIHAI180.0°180.0°
CANCBFNAYHNAY11.8°145.4°
CBGCAJCAHHAJ180.0°179.9°
CBGCAJCAHCAI0.0°0.1°
CAJCBGCANHAN180.0°179.8°
CBGCAJCAHHAH180.0°180.0°
CAJCAHCAIHAH180.0°179.9°
CAJCAHCAICBF0.0°0.3°
CAJCAHCAIHAI180.0°180.0°
CAHCAICBFHAI180.0°179.7°
CAHCAICBFNAY180.0°179.7°
CAICAHCAJHAJ180.0°180.0°
CAICBFNAYCBD11.9°145.4°
CAICBFCANHAN180.0°180.0°
CBFCAICAHHAH180.0°179.8°
CAICBFNAYHNAY168.2°34.6°
CBFNAYCBDHNAY180.0°180.0°
CBFNAYCBDCAQ177.8°174.3°
CBFNAYCBDOAE0.2°5.8°
NAYCBFCANHAN0.0°0.0°
NAYCBFCAIHAI0.0°0.0°
NAYCBDCAQOAE178.0°179.9°
NAYCBDCAQCAP114.0°180.0°
NAYCBDCAQHAQ66.0°0.0°
CBDCAQCAPHAQ180.0°180.0°
CAQCBDNAYHNAY2.1°5.6°
CBDCAQCAPHAP180.0°180.0°
CBDCAQCAPHAPA0.0°0.0°
OAECBDCAQCAP68.0°0.1°
OAECBDNAYHNAY179.9°174.3°
OAECBDCAQHAQ112.0°179.9°
CAQCAPHAPHAPA180.0°180.0°
HATCATCARHAR173.2°178.5°
HATCATCARHARA53.2°58.4°
HATACATCARHAR53.3°58.5°
HATACATCARHARA66.8°61.6°
HABCABHABAHABB120.0°120.0°
HASCASCAUHAU52.8°58.4°
HASCASCAUHAUA172.8°178.5°
HASACASCAUHAU67.2°61.6°
HASACASCAUHAUA52.8°58.4°
HAACAAHAAAHAAB120.0°119.9°
HAKCAKCALHAL0.1°0.1°
HAJCAJCAHHAH0.0°0.1°
HAHCAHCAIHAI0.0°0.0°
HAQCAQCAPHAP0.0°0.0°
HAQCAQCAPHAPA180.0°180.0°

217705

PDB entries from 2024-03-27

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