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4NK

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
CAANBEsing1.47Å1.47Å
OALCAXdoub1.21Å1.25Å
OAHCAXsing1.34Å1.25Å
CACNBEsing1.47Å1.46Å
CAXCBCsing1.51Å1.53Å
NBECBCsing1.47Å1.49Å
NBECABsing1.47Å1.46Å
CBCCAPsing1.53Å1.55Å
CAPCAYsing1.51Å1.54Å
CAYNARsing1.34Å1.32ÅAromatic
CAYCAMdoub1.35Å1.33ÅAromatic
NARCAZdoub1.30Å1.34ÅAromatic
CAMNATsing1.37Å1.34ÅAromatic
OAISBDdoub1.42Å1.53Å
CAZNATsing1.35Å1.32ÅAromatic
CAZSBDsing1.76Å1.82Å
SBDCAQsing1.81Å1.82Å
CAQCBBsing1.53Å1.50Å
OAKCAWdoub1.21Å1.26Å
CAWOAGsing1.34Å1.24Å
CAWCBBsing1.51Å1.55Å
CBBNASsing1.46Å1.47Å
OAECAUdoub1.21Å1.23Å
NASCAUsing1.35Å1.35Å
CAUCANsing1.51Å1.51Å
OXTCdoub1.21Å1.23Å
COsing1.34Å1.25Å
CCAsing1.51Å1.54Å
CACBsing1.53Å1.50Å
CANsing1.47Å1.44Å
CBCANsing1.53Å1.51Å
OH1sing0.97Å0.95Å
CAHAsing1.09Å1.10Å
NH2sing1.01Å1.00Å
NH3sing1.01Å1.00Å
CBHB2sing1.09Å1.10Å
CBHB1sing1.09Å1.10Å
CANHAOsing1.09Å1.10Å
CANHANsing1.09Å1.10Å
NASHASsing0.97Å1.00Å
CBBHBBsing1.09Å1.10Å
OAGH4sing0.97Å0.95Å
CAQHAQsing1.09Å1.10Å
CAQHB4sing1.09Å1.10Å
NATHATsing0.97Å1.00Å
CAMHAMsing1.08Å1.08Å
CAPHB3sing1.09Å1.10Å
CAPHAPsing1.09Å1.10Å
CBCHBCsing1.09Å1.10Å
OAHH7sing0.97Å0.95Å
CABHAFsing1.09Å1.10Å
CABHAEsing1.09Å1.10Å
CABHADsing1.09Å1.10Å
CACHAIsing1.09Å1.10Å
CACHAHsing1.09Å1.10Å
CACHAGsing1.09Å1.10Å
CAAHAAsing1.09Å1.10Å
CAAHACsing1.09Å1.10Å
CAAHABsing1.09Å1.10Å
NH6sing1.01Å1.00Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
CAANBECAC105.7°109.5°
CAANBECBC112.1°109.5°
CAANBECAB111.0°109.4°
NBECAAHAA109.5°109.5°
NBECAAHAC109.5°109.5°
NBECAAHAB109.5°109.4°
OALCAXOAH126.8°120.0°
OALCAXCBC117.0°120.0°
OAHCAXCBC116.2°120.0°
CAXOAHH7109.5°117.0°
CACNBECBC112.3°109.5°
CACNBECAB106.3°109.5°
NBECACHAI109.5°109.4°
NBECACHAH109.5°109.5°
NBECACHAG109.5°109.5°
CAXCBCNBE110.4°109.4°
CAXCBCCAP112.1°109.4°
CAXCBCHBC106.5°109.4°
CBCNBECAB109.2°109.4°
NBECBCCAP113.9°109.5°
NBECBCHBC107.0°109.5°
NBECABHAF109.5°109.5°
NBECABHAE109.5°109.5°
NBECABHAD109.5°109.4°
CBCCAPCAY114.2°109.4°
CBCCAPHB3108.3°109.5°
CBCCAPHAP108.3°109.5°
CAPCBCHBC106.4°109.5°
CAPCAYNAR128.1°126.0°
CAPCAYCAM123.2°126.0°
CAYCAPHB3108.3°109.5°
CAYCAPHAP108.3°109.5°
NARCAYCAM108.7°108.0°
CAYNARCAZ106.6°109.2°
CAYCAMNAT108.2°106.8°
CAYCAMHAM125.9°126.6°
NARCAZNAT109.3°108.7°
NARCAZSBD123.2°125.7°
CAMNATCAZ106.6°107.2°
CAMNATHAT126.7°126.4°
NATCAMHAM125.9°126.6°
OAISBDCAZ113.3°103.0°
OAISBDCAQ112.4°109.5°
NATCAZSBD126.8°125.6°
CAZNATHAT126.7°126.4°
CAZSBDCAQ109.6°103.0°
SBDCAQCBB109.1°109.4°
SBDCAQHAQ109.6°109.5°
SBDCAQHB4109.5°109.5°
CAQCBBCAW107.2°109.4°
CAQCBBNAS109.3°109.5°
CAQCBBHBB109.9°109.4°
CBBCAQHAQ109.5°109.4°
CBBCAQHB4109.6°109.4°
OAKCAWOAG124.4°120.0°
OAKCAWCBB119.5°120.0°
OAGCAWCBB116.1°120.0°
CAWOAGH4109.5°117.0°
CAWCBBNAS111.0°109.5°
CAWCBBHBB109.2°109.5°
CBBNASCAU121.8°120.0°
CBBNASHAS119.1°120.0°
NASCBBHBB110.3°109.5°
OAECAUNAS125.6°120.0°
OAECAUCAN117.0°120.0°
NASCAUCAN117.4°120.0°
CAUNASHAS119.2°120.0°
CAUCANCB106.0°109.5°
CAUCANHAO110.3°109.5°
CAUCANHAN110.4°109.5°
OXTCO124.7°120.0°
OXTCCA115.9°120.0°
OCCA119.4°120.0°
COH1109.5°116.9°
CCACB107.8°109.4°
CCAN108.1°109.5°
CCAHA110.9°109.5°
CBCAN105.7°109.5°
CACBCAN116.8°109.5°
CBCAHA111.6°109.5°
CACBHB2107.6°109.5°
CACBHB1107.6°109.5°
NCAHA112.5°109.5°
CANH2109.5°109.4°
CANH3109.5°109.5°
CANH6109.5°109.4°
CANCBHB2107.6°109.4°
CANCBHB1107.6°109.4°
CBCANHAO110.3°109.5°
CBCANHAN110.3°109.4°
H2NH3109.4°109.5°
H2NH6109.5°109.5°
H3NH6109.5°109.5°
HB2CBHB1109.5°109.5°
HAOCANHAN109.5°109.4°
HAQCAQHB4109.5°109.6°
HB3CAPHAP109.5°109.5°
HAFCABHAE109.5°109.5°
HAFCABHAD109.5°109.5°
HAECABHAD109.5°109.5°
HAICACHAH109.5°109.5°
HAICACHAG109.5°109.5°
HAHCACHAG109.4°109.4°
HAACAAHAC109.5°109.5°
HAACAAHAB109.4°109.5°
HACCAAHAB109.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
CAANBECACCBC122.5°120.1°
CAANBECACCAB118.0°120.0°
CAANBECBCCAX37.7°68.8°
CAANBECBCCAB123.4°120.0°
CAANBECBCCAP164.8°51.2°
CAANBECBCHBC77.9°171.3°
CAANBECABHAF180.0°161.5°
CAANBECABHAE60.0°78.5°
CAANBECABHAD60.0°41.5°
CAANBECACHAI180.0°48.8°
CAANBECACHAH60.0°71.2°
CAANBECACHAG60.0°168.9°
NBECAAHAAHAC120.0°120.0°
NBECAAHAAHAB120.0°119.9°
NBECAAHACHAB120.0°120.0°
OALCAXOAHCBC177.4°180.0°
OALCAXCBCNBE74.6°18.3°
OALCAXCBCCAP53.5°101.7°
OALCAXCBCHBC169.5°138.3°
OALCAXOAHH70.0°0.0°
OAHCAXCBCNBE103.0°161.7°
OAHCAXCBCCAP128.8°78.3°
OAHCAXCBCHBC12.9°41.7°
CACNBECBCCAX81.2°51.2°
CACNBECBCCAB117.8°120.0°
CACNBECBCCAP46.0°171.2°
CACNBECBCHBC163.2°68.7°
CACNBECABHAF65.5°78.5°
CACNBECABHAE174.5°41.5°
CACNBECABHAD54.5°161.5°
NBECACHAIHAH120.0°120.0°
NBECACHAIHAG120.0°120.0°
NBECACHAHHAG120.0°120.0°
CACNBECAAHAA180.0°172.1°
CACNBECAAHAC60.0°52.1°
CACNBECAAHAB60.0°67.9°
CAXCBCNBECAP127.1°120.0°
CAXCBCNBEHBC115.6°119.9°
CAXCBCNBECAB161.1°171.2°
CAXCBCCAPHBC116.1°120.0°
CAXCBCCAPCAY53.2°175.8°
CAXCBCCAPHB3173.9°55.8°
CAXCBCCAPHAP67.5°64.2°
CBCCAXOAHH7177.4°180.0°
NBECBCCAPHBC117.7°120.1°
NBECBCCAPCAY179.5°64.2°
NBECBCCAPHB359.8°175.8°
NBECBCCAPHAP58.8°55.8°
CBCNBECABHAF56.0°41.5°
CBCNBECABHAE64.0°161.5°
CBCNBECABHAD176.0°78.5°
CBCNBECACHAI57.5°71.3°
CBCNBECACHAH177.5°168.7°
CBCNBECACHAG62.5°48.8°
CBCNBECAAHAA57.3°67.8°
CBCNBECAAHAC62.7°172.2°
CBCNBECAAHAB177.3°52.1°
CABNBECBCCAP71.8°68.8°
CABNBECBCHBC45.5°51.3°
NBECABHAFHAE120.0°120.0°
NBECABHAFHAD120.0°120.0°
NBECABHAEHAD120.0°120.0°
CABNBECACHAI62.0°168.8°
CABNBECACHAH58.0°48.8°
CABNBECACHAG178.0°71.2°
CABNBECAAHAA65.1°52.2°
CABNBECAAHAC174.9°67.8°
CABNBECAAHAB54.9°172.1°
CBCCAPCAYHB3120.7°120.0°
CBCCAPCAYHAP120.7°120.0°
CBCCAPCAYNAR31.6°54.5°
CBCCAPCAYCAM150.0°125.1°
CBCCAPHB3HAP117.8°120.0°
CAPCAYNARCAM178.5°179.7°
CAPCAYNARCAZ178.4°180.0°
CAPCAYCAMNAT177.2°179.9°
CAPCAYCAMHAM2.8°0.3°
CAYCAPHB3HAP117.8°120.0°
CAYCAPCBCHBC62.8°55.9°
NARCAYCAMNAT1.4°0.4°
CAYNARCAZNAT6.5°0.0°
CAYNARCAZSBD177.7°179.7°
NARCAYCAMHAM178.6°180.0°
NARCAYCAPHB389.1°65.5°
NARCAYCAPHAP152.3°174.5°
CAMCAYNARCAZ3.0°0.3°
CAYCAMNATHAM180.0°179.6°
CAYCAMNATCAZ5.4°0.4°
CAYCAMNATHAT174.6°179.6°
CAMCAYCAPHB389.3°114.9°
CAMCAYCAPHAP29.3°5.2°
NARCAZNATCAM7.3°0.2°
NARCAZSBDOAI45.2°156.4°
NARCAZNATSBD170.8°179.8°
NARCAZSBDCAQ81.1°89.7°
NARCAZNATHAT172.6°179.8°
CAMNATCAZHAT180.0°180.0°
CAMNATCAZSBD178.1°180.0°
OAISBDCAZNAT145.2°23.8°
OAISBDCAZCAQ126.4°113.9°
OAISBDCAQCBB134.4°70.9°
OAISBDCAQHAQ14.5°169.1°
OAISBDCAQHB4105.7°49.0°
NATCAZSBDCAQ88.4°90.0°
CAZNATCAMHAM174.6°180.0°
CAZSBDCAQCBB98.7°180.0°
CAZSBDCAQHAQ141.4°60.0°
CAZSBDCAQHB421.2°60.1°
SBDCAZNATHAT1.9°0.0°
SBDCAQCBBHAQ119.9°120.0°
SBDCAQCBBHB4119.9°120.0°
SBDCAQCBBCAW61.4°180.0°
SBDCAQCBBNAS178.3°60.0°
SBDCAQCBBHBB57.1°60.0°
SBDCAQHAQHB4120.2°120.1°
CAQCBBCAWOAK37.9°120.0°
CAQCBBCAWOAG141.1°60.0°
CAQCBBCAWNAS119.2°120.0°
CAQCBBCAWHBB119.0°120.0°
CAQCBBNASHBB120.9°120.0°
CAQCBBNASCAU58.8°155.0°
CAQCBBNASHAS121.2°25.0°
CBBCAQHAQHB4120.2°120.0°
OAKCAWOAGCBB178.9°180.0°
OAKCAWCBBNAS81.3°0.0°
OAKCAWCBBHBB156.9°120.0°
OAKCAWOAGH40.0°0.0°
OAGCAWCBBNAS99.7°180.0°
OAGCAWCBBHBB22.1°59.9°
CAWCBBNASHBB121.1°120.1°
CAWCBBNASCAU176.8°85.0°
CAWCBBNASHAS3.3°94.9°
CBBCAWOAGH4179.0°180.0°
CAWCBBCAQHAQ58.5°60.1°
CAWCBBCAQHB4178.7°60.0°
CBBNASCAUOAE1.4°0.0°
CBBNASCAUHAS180.0°180.0°
CBBNASCAUCAN180.0°180.0°
NASCBBCAQHAQ61.8°59.9°
NASCBBCAQHB458.3°180.0°
OAECAUNASCAN178.6°180.0°
OAECAUCANCB70.8°0.0°
OAECAUCANHAO48.7°120.1°
OAECAUCANHAN169.8°119.9°
OAECAUNASHAS178.6°179.9°
NASCAUCANCB110.5°180.0°
NASCAUCANHAO130.0°60.0°
NASCAUCANHAN8.9°60.0°
CAUNASCBBHBB62.1°35.1°
CAUCANCBCA68.0°180.0°
CAUCANCBHAO119.4°120.0°
CAUCANCBHAN119.5°120.0°
CAUCANCBHB2171.0°60.0°
CAUCANCBHB153.1°60.0°
CAUCANHAOHAN121.6°120.0°
CANCAUNASHAS0.0°0.0°
OXTCOCA179.3°180.0°
OXTCCACB26.2°100.0°
OXTCCAN140.0°19.9°
OXTCOH10.0°0.0°
OXTCCAHA96.2°140.0°
OCCACB153.1°80.0°
OCCAN39.3°160.0°
OCCAHA84.5°40.0°
CCACBN115.4°120.0°
CCACBHA122.0°120.0°
CCANHA122.9°120.0°
CCACBCAN179.9°175.0°
CACOH1179.3°180.0°
CCANH2180.0°60.0°
CCANH360.0°60.0°
CCACBHB259.1°65.0°
CCACBHB158.8°55.0°
CCANH660.0°180.0°
CBCANHA122.0°120.0°
CACBCANHB2121.1°120.0°
CACBCANHB1121.1°120.0°
CBCANH264.9°180.0°
CBCANH3175.2°60.0°
CACBHB2HB1116.7°120.0°
CACBCANHAO172.6°59.9°
CACBCANHAN51.5°60.0°
CBCANH655.2°60.0°
NCACBCAN64.7°65.0°
CANH2H3120.0°120.0°
CANH2H6120.0°119.9°
CANH3H6120.0°120.0°
NCACBHB256.4°55.0°
NCACBHB1174.3°175.0°
CANCBCAHA57.9°55.0°
CANCBHB2HB1116.7°120.0°
CBCANHAOHAN121.6°119.9°
HACANH257.1°60.0°
HACANH362.9°180.0°
HACACBHB2178.9°175.0°
HACACBHB163.2°65.0°
HACANH6177.2°60.0°
H2NH3H6120.0°120.1°
HB2CBCANHAO51.5°180.0°
HB2CBCANHAN69.6°60.0°
HB1CBCANHAO66.4°60.1°
HB1CBCANHAN172.5°180.0°
HASNASCBBHBB117.9°145.0°
HBBCBBCAQHAQ177.1°179.9°
HBBCBBCAQHB462.8°60.0°
HATNATCAMHAM5.4°0.0°
HB3CAPCBCHBC57.9°64.1°
HAPCAPCBCHBC176.4°175.9°
HAFCABHAEHAD120.0°120.0°
HAICACHAHHAG120.0°120.0°
HAACAAHACHAB120.0°120.0°

222415

PDB entries from 2024-07-10

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