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GRD

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C4C5doub1.41Å1.38ÅAromatic
C4N3sing1.33Å1.37ÅAromatic
C4N9sing1.37Å1.34ÅAromatic
C5C6sing1.41Å1.39ÅAromatic
C5N7sing1.35Å1.37ÅAromatic
C6N1doub1.33Å1.37ÅAromatic
C6N6sing1.38Å1.35Å
C8N7doub1.30Å1.34ÅAromatic
C8N9sing1.36Å1.34ÅAromatic
N1C2sing1.32Å1.35ÅAromatic
N3C2doub1.32Å1.36ÅAromatic
CANCALdoub1.38Å1.40ÅAromatic
CANCAQsing1.38Å1.40ÅAromatic
CALCAMsing1.38Å1.40ÅAromatic
CAUCATsing1.53Å1.51Å
CAUN1Csing1.46Å1.47Å
CBMCAQdoub1.38Å1.40ÅAromatic
CBMCAWsing1.51Å1.48Å
CBMCAPsing1.38Å1.40ÅAromatic
CAACASsing1.53Å1.51Å
OAHCBJdoub1.21Å1.23Å
OAGCBIdoub1.22Å1.22Å
CASCBSsing1.53Å1.55Å
CATCAVsing1.53Å1.52Å
N9CAVsing1.47Å1.46Å
OAICBKdoub1.21Å1.22Å
CBKN1Csing1.35Å1.33Å
CBKCBUsing1.51Å1.50Å
CBUOAJsing1.43Å1.45Å
CBUCBSsing1.53Å1.52Å
CBSN1Esing1.46Å1.48Å
N1ECBJsing1.35Å1.33Å
CBJCBRsing1.51Å1.51Å
CBRCAYsing1.53Å1.53Å
CBRN1Dsing1.47Å1.46Å
CAYCBPsing1.53Å1.53Å
CBPCABsing1.53Å1.53Å
CBPCACsing1.53Å1.53Å
N1DCBIsing1.35Å1.35Å
CBIOBFsing1.35Å1.44Å
OBFCAWsing1.45Å1.46Å
CAPCAMdoub1.38Å1.40ÅAromatic
C8H8sing1.08Å1.08Å
CANHANsing1.08Å1.08Å
CALHALsing1.08Å1.08Å
CAUHAUsing1.09Å1.10Å
CAUHAUAsing1.09Å1.10Å
CAQHAQsing1.08Å1.08Å
CAAHAAsing1.09Å1.10Å
CAAHAAAsing1.09Å1.10Å
CAAHAABsing1.09Å1.10Å
CASHASsing1.09Å1.10Å
CASHASAsing1.09Å1.10Å
CATHATsing1.09Å1.10Å
CATHATAsing1.09Å1.10Å
C2H2sing1.08Å1.08Å
N6HN6sing0.97Å1.00Å
N6HN6Asing0.97Å1.00Å
N1CHN1Csing0.97Å1.00Å
CAVHAVsing1.09Å1.10Å
CAVHAVAsing1.09Å1.10Å
CBUHBUsing1.09Å1.10Å
OAJHOAJsing0.97Å0.95Å
CBSHBSsing1.09Å1.10Å
N1EHN1Esing0.97Å1.00Å
CBRHBRsing1.09Å1.10Å
CAYHAYsing1.09Å1.10Å
CAYHAYAsing1.09Å1.10Å
CBPHBPsing1.09Å1.10Å
CABHABsing1.09Å1.10Å
CABHABAsing1.09Å1.10Å
CABHABBsing1.09Å1.10Å
CACHACsing1.09Å1.10Å
CACHACAsing1.09Å1.10Å
CACHACBsing1.09Å1.10Å
N1DHN1Dsing0.97Å1.00Å
CAWHAWsing1.09Å1.10Å
CAWHAWAsing1.09Å1.10Å
CAPHAPsing1.08Å1.08Å
CAMHAMsing1.08Å1.08Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
C5C4N3121.0°119.1°
C5C4N9107.0°106.0°
C4C5C6118.2°118.1°
C4C5N7108.1°107.1°
N3C4N9132.0°135.0°
C4N3C2119.7°120.6°
C4N9C8108.1°107.5°
C4N9CAV126.5°126.2°
C6C5N7133.7°134.7°
C5C6N1119.7°118.5°
C5C6N6120.0°120.8°
C5N7C8106.3°109.5°
N1C6N6120.3°120.8°
C6N1C2121.3°121.2°
C6N6HN6109.5°120.0°
C6N6HN6A109.5°120.0°
N7C8N9110.5°110.0°
N7C8H8124.7°125.0°
C8N9CAV125.4°126.3°
N9C8H8124.7°125.0°
N1C2N3120.1°122.5°
N1C2H2119.9°118.8°
N3C2H2120.0°118.7°
CALCANCAQ119.6°120.0°
CANCALCAM120.5°120.0°
CALCANHAN120.2°120.0°
CANCALHAL119.7°120.0°
CANCAQCBM119.9°120.0°
CAQCANHAN120.2°119.9°
CANCAQHAQ120.0°120.0°
CALCAMCAP119.7°120.0°
CAMCALHAL119.8°120.0°
CALCAMHAM120.2°120.0°
CATCAUN1C111.6°109.4°
CAUCATCAV108.6°109.5°
CATCAUHAU108.8°109.5°
CATCAUHAUA108.3°109.4°
CAUCATHAT109.7°109.5°
CAUCATHATA110.0°109.5°
CAUN1CCBK122.7°120.0°
N1CCAUHAU108.8°109.4°
N1CCAUHAUA108.3°109.5°
CAUN1CHN1C118.6°120.0°
CAQCBMCAW119.6°120.0°
CAQCBMCAP120.3°120.0°
CBMCAQHAQ120.0°120.0°
CAWCBMCAP120.1°120.0°
CBMCAWOBF118.7°109.5°
CBMCAWHAW106.5°109.4°
CBMCAWHAWA104.4°109.5°
CBMCAPCAM119.9°120.0°
CBMCAPHAP120.0°120.0°
CAACASCBS110.3°109.4°
CASCAAHAA109.5°109.5°
CASCAAHAAA109.5°109.5°
CASCAAHAAB109.5°109.5°
CAACASHAS109.2°109.5°
CAACASHASA109.0°109.5°
OAHCBJN1E123.9°120.0°
OAHCBJCBR120.0°120.0°
OAGCBIN1D122.8°120.0°
OAGCBIOBF117.4°120.0°
CASCBSCBU110.9°109.5°
CASCBSN1E108.4°109.5°
CBSCASHAS109.2°109.5°
CBSCASHASA109.0°109.4°
CASCBSHBS108.0°109.5°
CATCAVN9115.6°109.5°
CAVCATHAT109.8°109.4°
CAVCATHATA110.0°109.5°
CATCAVHAV107.5°109.5°
CATCAVHAVA106.1°109.5°
N9CAVHAV107.5°109.4°
N9CAVHAVA106.1°109.4°
OAICBKN1C124.2°120.0°
OAICBKCBU117.4°120.0°
N1CCBKCBU118.3°120.0°
CBKN1CHN1C118.6°120.0°
CBKCBUOAJ110.1°109.5°
CBKCBUCBS110.0°109.5°
CBKCBUHBU111.5°109.4°
OAJCBUCBS116.4°109.4°
OAJCBUHBU104.2°109.5°
CBUOAJHOAJ109.5°114.0°
CBUCBSN1E105.1°109.5°
CBSCBUHBU104.4°109.5°
CBUCBSHBS111.0°109.4°
CBSN1ECBJ123.7°120.0°
N1ECBSHBS113.5°109.5°
CBSN1EHN1E118.1°120.0°
N1ECBJCBR116.1°120.0°
CBJN1EHN1E118.1°120.0°
CBJCBRCAY107.7°109.5°
CBJCBRN1D109.0°109.5°
CBJCBRHBR110.6°109.5°
CAYCBRN1D108.6°109.4°
CBRCAYCBP114.3°109.5°
CAYCBRHBR111.0°109.5°
CBRCAYHAY107.9°109.5°
CBRCAYHAYA106.8°109.5°
CBRN1DCBI121.1°120.0°
N1DCBRHBR109.8°109.5°
CBRN1DHN1D119.5°120.1°
CAYCBPCAB109.3°109.5°
CAYCBPCAC111.2°109.5°
CBPCAYHAY107.9°109.5°
CBPCAYHAYA106.8°109.4°
CAYCBPHBP108.9°109.5°
CABCBPCAC110.9°109.4°
CABCBPHBP109.2°109.5°
CBPCABHAB109.5°109.4°
CBPCABHABA109.5°109.4°
CBPCABHABB109.4°109.4°
CACCBPHBP107.3°109.4°
CBPCACHAC109.5°109.5°
CBPCACHACA109.5°109.5°
CBPCACHACB109.4°109.5°
N1DCBIOBF119.8°120.0°
CBIN1DHN1D119.4°120.0°
CBIOBFCAW112.3°117.0°
OBFCAWHAW106.5°109.4°
OBFCAWHAWA104.3°109.5°
CAMCAPHAP120.0°120.0°
CAPCAMHAM120.2°120.0°
HAUCAUHAUA111.1°109.5°
HAACAAHAAA109.5°109.5°
HAACAAHAAB109.5°109.4°
HAAACAAHAAB109.5°109.5°
HASCASHASA110.1°109.5°
HATCATHATA108.8°109.5°
HN6N6HN6A109.5°120.0°
HAVCAVHAVA114.4°109.5°
HAYCAYHAYA113.3°109.5°
HABCABHABA109.5°109.5°
HABCABHABB109.5°109.5°
HABACABHABB109.5°109.6°
HACCACHACA109.5°109.4°
HACCACHACB109.4°109.4°
HACACACHACB109.5°109.5°
HAWCAWHAWA117.0°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
C5C4N3N9178.8°179.7°
C4C5C6N7178.7°180.0°
C4C5C6N11.4°0.0°
C4C5C6N6178.5°180.0°
C4C5N7C80.3°0.0°
C5C4N9C80.3°0.4°
C5C4N3C20.6°0.0°
C5C4N9CAV177.4°180.0°
N3C4C5C61.6°0.0°
N3C4C5N7179.4°180.0°
N3C4N9C8179.1°179.9°
C4N3C2N10.6°0.0°
N3C4N9CAV1.5°0.3°
C4N3C2H2179.4°180.0°
N9C4C5C6179.3°179.7°
N9C4C5N70.3°0.2°
C4N9C8N70.1°0.4°
C4N9C8CAV177.7°179.6°
N9C4N3C2179.4°179.7°
C4N9CAVCAT75.5°84.9°
C4N9C8H8179.9°179.8°
C4N9CAVHAV164.5°35.0°
C4N9CAVHAVA41.7°155.0°
C5C6N1N6179.9°180.0°
C6C5N7C8179.1°180.0°
C5C6N1C20.2°0.0°
C5C6N6HN618.4°0.0°
C5C6N6HN6A138.4°180.0°
N7C5C6N1179.9°180.0°
N7C5C6N60.2°0.0°
C5N7C8N90.1°0.3°
C5N7C8H8179.9°180.0°
C6N1C2N30.8°0.0°
C6N1C2H2179.2°180.0°
N1C6N6HN6161.7°180.0°
N1C6N6HN6A41.7°0.0°
N6C6N1C2179.7°180.0°
C6N6HN6HN6A120.0°180.0°
N7C8N9H8180.0°179.7°
N7C8N9CAV177.6°180.0°
C8N9CAVCAT107.2°94.6°
C8N9CAVHAV12.8°145.4°
C8N9CAVHAVA135.6°25.5°
N1C2N3H2180.0°179.9°
CALCANCAQHAN180.0°179.8°
CANCALCAMHAL180.0°180.0°
CALCANCAQCBM0.3°0.0°
CANCALCAMCAP0.4°0.1°
CALCANCAQHAQ179.7°179.9°
CANCALCAMHAM179.6°179.9°
CAQCANCALCAM0.5°0.0°
CANCAQCBMHAQ180.0°180.0°
CANCAQCBMCAW179.7°180.0°
CANCAQCBMCAP0.0°0.0°
CAQCANCALHAL179.5°180.0°
CALCAMCAPCBM0.1°0.1°
CALCAMCAPHAM180.0°179.9°
CAMCALCANHAN179.5°179.8°
CALCAMCAPHAP179.9°180.0°
CATCAUN1CHAU120.0°120.0°
CATCAUN1CHAUA119.1°120.0°
CAUCATCAVHAT120.0°120.0°
CAUCATCAVHATA120.4°120.0°
CAUCATCAVN975.9°180.0°
CATCAUN1CCBK153.9°180.0°
CATCAUHAUHAUA119.2°120.0°
CAUCATHATHATA120.4°120.0°
CATCAUN1CHN1C26.1°0.0°
CAUCATCAVHAV44.1°60.1°
CAUCATCAVHAVA166.9°60.0°
N1CCAUCATCAV178.1°180.0°
CAUN1CCBKOAI0.3°0.0°
CAUN1CCBKHN1C180.0°180.0°
CAUN1CCBKCBU179.9°180.0°
N1CCAUHAUHAUA119.1°120.0°
N1CCAUCATHAT58.1°60.0°
N1CCAUCATHATA61.5°60.0°
CAQCBMCAWCAP179.8°180.0°
CAQCBMCAWOBF0.9°90.0°
CAQCBMCAPCAM0.0°0.0°
CBMCAQCANHAN179.7°179.8°
CAQCBMCAWHAW120.9°150.0°
CAQCBMCAWHAWA114.7°30.0°
CAQCBMCAPHAP179.9°179.9°
CBMCAWOBFCBI142.7°180.0°
CBMCAWOBFHAW120.0°119.9°
CBMCAWOBFHAWA115.6°120.0°
CAWCBMCAPCAM179.8°180.0°
CAWCBMCAQHAQ0.2°0.0°
CBMCAWHAWHAWA116.2°120.0°
CAWCBMCAPHAP0.2°0.1°
CAPCBMCAWOBF178.9°89.9°
CBMCAPCAMHAP180.0°179.9°
CAPCBMCAQHAQ180.0°179.9°
CAPCBMCAWHAW58.9°30.0°
CAPCBMCAWHAWA65.5°150.0°
CBMCAPCAMHAM179.9°179.9°
CAACASCBSHAS120.0°120.0°
CAACASCBSHASA119.7°120.0°
CAACASCBSCBU176.6°175.0°
CAACASCBSN1E68.5°65.0°
CASCAAHAAHAAA120.0°120.0°
CASCAAHAAHAAB120.0°120.1°
CASCAAHAAAHAAB120.0°120.1°
CAACASHASHASA119.7°120.0°
CAACASCBSHBS54.7°55.1°
OAHCBJN1ECBS1.4°2.8°
OAHCBJN1ECBR179.3°180.0°
OAHCBJCBRCAY90.9°107.2°
OAHCBJCBRN1D26.8°12.8°
OAHCBJN1EHN1E178.6°177.3°
OAHCBJCBRHBR147.5°132.8°
OAGCBIN1DCBR2.8°4.9°
OAGCBIN1DOBF178.6°180.0°
OAGCBIOBFCAW46.0°0.1°
OAGCBIN1DHN1D177.3°175.0°
CASCBSCBUCBK67.0°65.0°
CASCBSCBUOAJ59.1°55.0°
CASCBSCBUN1E116.9°120.0°
CASCBSCBUHBS120.0°120.0°
CASCBSN1EHBS119.9°120.0°
CASCBSN1ECBJ109.4°85.1°
CBSCASCAAHAA140.5°180.0°
CBSCASCAAHAAA99.4°60.1°
CBSCASCAAHAAB20.5°60.0°
CBSCASHASHASA119.7°120.0°
CASCBSCBUHBU173.3°175.0°
CASCBSN1EHN1E70.6°95.0°
CATCAVN9HAV120.0°120.0°
CATCAVN9HAVA117.2°120.1°
CAVCATCAUHAU58.1°60.0°
CAVCATCAUHAUA62.8°60.0°
CAVCATHATHATA120.4°120.0°
CATCAVHAVHAVA117.5°120.1°
CAVN9C8H82.4°0.2°
N9CAVCATHAT164.1°60.0°
N9CAVCATHATA44.5°60.0°
N9CAVHAVHAVA117.5°119.9°
OAICBKN1CCBU179.9°179.9°
OAICBKCBUOAJ165.7°5.0°
OAICBKCBUCBS64.7°115.0°
OAICBKN1CHN1C179.8°180.0°
OAICBKCBUHBU50.6°125.0°
N1CCBKCBUOAJ14.4°175.0°
N1CCBKCBUCBS115.2°65.0°
CBKN1CCAUHAU33.9°60.0°
CBKN1CCAUHAUA86.9°60.0°
N1CCBKCBUHBU129.6°55.1°
CBKCBUOAJCBS126.0°120.0°
CBKCBUOAJHBU119.7°120.0°
CBKCBUCBSHBU119.7°120.0°
CBKCBUCBSN1E176.1°175.0°
CBUCBKN1CHN1C0.1°0.0°
CBKCBUOAJHOAJ91.1°60.0°
CBKCBUCBSHBS53.0°55.0°
OAJCBUCBSHBU114.2°120.0°
OAJCBUCBSN1E57.8°65.0°
OAJCBUCBSHBS179.1°175.0°
CBUCBSN1EHBS121.5°120.0°
CBUCBSN1ECBJ131.9°155.0°
CBUCBSCASHAS56.6°55.0°
CBUCBSCASHASA63.8°65.0°
CBSCBUOAJHOAJ142.8°60.0°
CBUCBSN1EHN1E48.1°25.0°
CBSN1ECBJHN1E180.0°179.9°
CBSN1ECBJCBR177.9°177.3°
N1ECBSCASHAS171.5°175.0°
N1ECBSCASHASA51.1°55.0°
N1ECBSCBUHBU56.4°55.0°
N1ECBJCBRCAY89.7°72.9°
N1ECBJCBRN1D152.6°167.2°
CBJN1ECBSHBS10.4°35.0°
N1ECBJCBRHBR31.8°47.2°
CBJCBRCAYN1D118.0°120.0°
CBJCBRCAYHBR121.2°120.1°
CBJCBRN1DHBR121.3°120.0°
CBJCBRCAYCBP179.3°61.4°
CBJCBRN1DCBI69.8°158.4°
CBRCBJN1EHN1E2.1°2.7°
CBJCBRCAYHAY59.3°178.6°
CBJCBRCAYHAYA62.8°58.5°
CBJCBRN1DHN1D110.2°21.6°
CAYCBRN1DHBR121.6°120.0°
CBRCAYCBPHAY120.0°120.0°
CBRCAYCBPHAYA117.9°120.0°
CBRCAYCBPCAB179.9°66.3°
CBRCAYCBPCAC57.2°173.7°
CAYCBRN1DCBI173.1°81.7°
CBRCAYHAYHAYA118.0°120.0°
CBRCAYCBPHBP60.8°53.8°
CAYCBRN1DHN1D7.0°98.4°
N1DCBRCAYCBP61.3°178.6°
CBRN1DCBIHN1D180.0°180.0°
CBRN1DCBIOBF178.7°175.1°
N1DCBRCAYHAY58.7°58.6°
N1DCBRCAYHAYA179.2°61.4°
CAYCBPCABCAC122.9°120.0°
CAYCBPCABHBP119.1°120.1°
CAYCBPCACHBP119.0°120.0°
CBPCAYCBRHBR59.5°58.6°
CBPCAYHAYHAYA118.0°120.0°
CAYCBPCABHAB60.5°55.8°
CAYCBPCABHABA59.5°64.2°
CAYCBPCABHABB179.5°175.8°
CAYCBPCACHAC114.5°60.0°
CAYCBPCACHACA5.5°180.0°
CAYCBPCACHACB125.6°60.0°
CABCBPCACHBP119.2°120.0°
CABCBPCAYHAY60.1°53.7°
CABCBPCAYHAYA62.0°173.7°
CBPCABHABHABA120.0°120.0°
CBPCABHABHABB120.0°119.9°
CBPCABHABAHABB120.0°120.0°
CABCBPCACHAC7.3°180.0°
CABCBPCACHACA127.4°60.0°
CABCBPCACHACB112.6°60.0°
CACCBPCAYHAY177.2°66.2°
CACCBPCAYHAYA60.7°53.8°
CACCBPCABHAB176.6°175.8°
CACCBPCABHABA63.4°55.8°
CACCBPCABHABB56.6°64.2°
CBPCACHACHACA120.0°120.1°
CBPCACHACHACB120.0°120.0°
CBPCACHACAHACB120.0°120.0°
N1DCBIOBFCAW135.3°180.0°
CBIN1DCBRHBR51.5°38.3°
OBFCBIN1DHN1D1.3°4.9°
CBIOBFCAWHAW22.7°60.1°
CBIOBFCAWHAWA101.7°59.9°
OBFCAWHAWHAWA116.2°120.0°
CAPCAMCALHAL179.6°180.0°
HANCANCALHAL0.5°0.2°
HANCANCAQHAQ0.3°0.3°
HALCALCAMHAM0.4°0.1°
HAUCAUCATHAT61.9°60.0°
HAUCAUCATHATA178.4°180.0°
HAUCAUN1CHN1C146.1°120.0°
HAUACAUCATHAT177.2°180.0°
HAUACAUCATHATA57.6°60.0°
HAUACAUN1CHN1C93.0°120.0°
HAACAAHAAAHAAB120.0°119.9°
HAACAACASHAS99.5°60.0°
HAACAACASHASA20.9°60.0°
HAAACAACASHAS20.5°60.0°
HAAACAACASHASA140.9°180.0°
HAABCAACASHAS140.5°180.0°
HAABCAACASHASA99.1°60.0°
HASCASCBSHBS65.3°65.0°
HASACASCBSHBS174.4°175.0°
HATCATCAVHAV75.9°180.0°
HATCATCAVHAVA46.9°60.0°
HATACATCAVHAV164.5°60.0°
HATACATCAVHAVA72.7°180.0°
HBUCBUOAJHOAJ28.5°179.9°
HBUCBUCBSHBS66.7°65.0°
HBSCBSN1EHN1E169.6°144.9°
HBRCBRCAYHAY179.5°61.4°
HBRCBRCAYHAYA58.4°178.6°
HBRCBRN1DHN1D128.5°141.6°
HAYCAYCBPHBP59.2°173.8°
HAYACAYCBPHBP178.7°66.2°
HBPCBPCABHAB58.5°64.2°
HBPCBPCABHABA178.6°175.8°
HBPCBPCABHABB61.5°55.7°
HBPCBPCACHAC126.5°60.0°
HBPCBPCACHACA113.5°60.0°
HBPCBPCACHACB6.6°180.0°
HABCABHABAHABB120.0°120.1°
HACCACHACAHACB120.0°119.9°
HAPCAPCAMHAM0.1°0.2°

248636

PDB entries from 2026-02-04

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