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SFE

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
NCBsing1.47Å1.51Å
CACBsing1.53Å1.56Å
CACsing1.51Å1.56Å
CD2CGsing1.38Å1.39ÅAromatic
CD2CE2doub1.38Å1.39ÅAromatic
OCdoub1.21Å1.27Å
OXTCsing1.34Å1.25Å
CGCD1doub1.38Å1.40ÅAromatic
CGCBsing1.51Å1.53Å
CD1CE1sing1.38Å1.39ÅAromatic
CE1CZdoub1.38Å1.39ÅAromatic
CZCE2sing1.38Å1.40ÅAromatic
NHN1sing1.01Å1.00Å
NHN2sing1.01Å1.00Å
CBHBsing1.09Å1.10Å
CAHA1Csing1.09Å1.10Å
CAHA2Csing1.09Å1.10Å
CD2HD2sing1.08Å1.08Å
CE2HE2sing1.08Å1.08Å
CD1HD1sing1.08Å1.08Å
CE1HE1sing1.08Å1.08Å
CZHZsing1.08Å1.08Å
OXTHXTsing0.97Å0.95Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
NCBCA116.9°109.5°
NCBCG107.3°109.5°
CBNHN1109.5°111.0°
CBNHN2109.5°111.0°
NCBHB105.8°109.4°
CBCAC112.8°109.4°
CACBCG109.1°109.4°
CACBHB103.8°109.5°
CBCAHA1C108.4°109.5°
CBCAHA2C108.4°109.5°
CACO118.6°120.0°
CACOXT116.0°120.0°
CCAHA1C108.4°109.5°
CCAHA2C108.4°109.4°
CGCD2CE2118.8°120.0°
CD2CGCD1120.4°120.0°
CD2CGCB119.5°120.0°
CGCD2HD2120.6°120.0°
CD2CE2CZ120.5°120.0°
CE2CD2HD2120.6°120.0°
CD2CE2HE2119.7°120.0°
OCOXT125.4°120.0°
COXTHXT109.5°117.0°
CD1CGCB120.0°120.1°
CGCD1CE1121.0°120.0°
CGCD1HD1119.5°120.0°
CGCBHB114.1°109.5°
CD1CE1CZ118.7°120.0°
CE1CD1HD1119.5°120.0°
CD1CE1HE1120.6°120.0°
CE1CZCE2120.6°120.0°
CZCE1HE1120.7°120.0°
CE1CZHZ119.7°120.1°
CZCE2HE2119.8°120.1°
CE2CZHZ119.7°119.9°
HN1NHN2109.4°111.0°
HA1CCAHA2C110.5°109.5°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
NCBCACG121.9°120.0°
NCBCAHB116.1°120.0°
NCBCAC160.5°65.0°
NCBCGCD2100.2°140.0°
NCBCGCD178.3°39.4°
NCBCGHB116.8°120.0°
CBNHN1HN2120.0°123.9°
NCBCAHA1C40.5°175.1°
NCBCAHA2C79.5°55.0°
CBCACHA1C120.0°120.0°
CBCACHA2C120.0°120.0°
CACBCGCD2132.3°100.0°
CBCACO143.7°0.0°
CBCACOXT37.1°180.0°
CACBCGCD149.2°80.6°
CACBCGHB115.6°120.0°
CACBNHN1180.0°176.1°
CACBNHN260.0°60.0°
CBCAHA1CHA2C118.6°120.0°
CACOOXT179.1°180.0°
CCACBCG77.6°175.0°
CCACBHB44.4°55.0°
CCAHA1CHA2C118.6°120.0°
CACOXTHXT179.2°180.0°
CGCD2CE2HD2180.0°179.4°
CD2CGCD1CB178.5°179.4°
CD2CGCD1CE10.5°0.8°
CGCD2CE2CZ0.5°0.0°
CD2CGCBHB16.7°20.0°
CGCD2CE2HE2179.6°180.0°
CD2CGCD1HD1179.5°179.7°
CE2CD2CGCD10.7°0.6°
CE2CD2CGCB179.2°180.0°
CD2CE2CZCE10.0°0.3°
CD2CE2CZHE2180.0°180.0°
CD2CE2CZHZ180.0°180.0°
OCCAHA1C96.3°120.0°
OCCAHA2C23.6°120.0°
OCOXTHXT0.0°0.0°
OXTCCAHA1C82.9°60.0°
OXTCCAHA2C157.1°60.0°
CGCD1CE1HD1180.0°179.5°
CGCD1CE1CZ0.1°0.5°
CD1CGCBHB164.8°159.4°
CD1CGCD2HD2179.3°180.0°
CGCD1CE1HE1180.0°179.4°
CBCGCD1CE1179.0°179.8°
CGCBNHN157.1°64.0°
CGCBNHN262.8°59.9°
CGCBCAHA1C162.4°55.0°
CGCBCAHA2C42.4°65.0°
CBCGCD2HD20.8°0.6°
CBCGCD1HD11.0°0.3°
CD1CE1CZHE1180.0°179.9°
CD1CE1CZCE20.2°0.1°
CD1CE1CZHZ179.8°179.8°
CE1CZCE2HZ180.0°179.7°
CE1CZCE2HE2180.0°179.7°
CZCE1CD1HD1179.9°180.0°
CZCE2CD2HD2179.5°179.4°
CE2CZCE1HE1179.8°180.0°
HN1NCBHB65.0°56.1°
HN2NCBHB175.0°180.0°
HBCBCAHA1C75.6°65.0°
HBCBCAHA2C164.5°175.0°
HD2CD2CE2HE20.5°0.6°
HE2CE2CZHZ0.0°0.0°
HD1CD1CE1HE10.1°0.1°
HE1CE1CZHZ0.2°0.3°

222415

PDB entries from 2024-07-10

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