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PLM

Bonds
First atomSecond atomBond order typeDistance
(experimental model)
Distance
(ideal model)
Properties
C1O1sing1.34Å1.24Å
C1O2doub1.21Å1.25Å
C1C2sing1.51Å1.52Å
O1Hsing0.97Å0.95Å
C2C3sing1.53Å1.53Å
C2H21sing1.09Å1.11Å
C2H22sing1.09Å1.12Å
C3C4sing1.53Å1.52Å
C3H31sing1.09Å1.11Å
C3H32sing1.09Å1.11Å
C4C5sing1.53Å1.52Å
C4H41sing1.09Å1.11Å
C4H42sing1.09Å1.12Å
C5C6sing1.53Å1.51Å
C5H51sing1.09Å1.12Å
C5H52sing1.09Å1.12Å
C6C7sing1.53Å1.52Å
C6H61sing1.09Å1.12Å
C6H62sing1.09Å1.12Å
C7C8sing1.53Å1.51Å
C7H71sing1.09Å1.12Å
C7H72sing1.09Å1.12Å
C8C9sing1.53Å1.52Å
C8H81sing1.09Å1.11Å
C8H82sing1.09Å1.12Å
C9CAsing1.53Å1.52Å
C9H91sing1.09Å1.12Å
C9H92sing1.09Å1.11Å
CACBsing1.53Å1.52Å
CAHA1sing1.09Å1.11Å
CAHA2sing1.09Å1.11Å
CBCCsing1.53Å1.52Å
CBHB1sing1.09Å1.12Å
CBHB2sing1.09Å1.12Å
CCCDsing1.53Å1.52Å
CCHC1sing1.09Å1.11Å
CCHC2sing1.09Å1.11Å
CDCEsing1.53Å1.53Å
CDHD1sing1.09Å1.12Å
CDHD2sing1.09Å1.12Å
CECFsing1.53Å1.52Å
CEHE1sing1.09Å1.11Å
CEHE2sing1.09Å1.11Å
CFCGsing1.53Å1.52Å
CFHF1sing1.09Å1.12Å
CFHF2sing1.09Å1.11Å
CGHG1sing1.09Å1.11Å
CGHG2sing1.09Å1.12Å
CGHG3sing1.09Å1.12Å
Angles
First atomSecond atomThird atomAngle
(experimental model)
Angle
(ideal model)
O1C1O2122.7°120.0°
O1C1C2118.2°120.0°
C1O1H122.7°120.1°
O2C1C2119.1°120.0°
C1C2C3113.6°109.5°
C1C2H21110.7°109.5°
C1C2H22110.7°109.6°
C3C2H21110.7°109.4°
C3C2H22110.7°109.5°
C2C3C4110.0°109.6°
C2C3H31111.9°109.4°
C2C3H32112.0°109.5°
H21C2H2299.6°109.4°
C4C3H31112.0°109.5°
C4C3H32112.0°109.5°
C3C4C5112.5°109.5°
C3C4H41111.1°109.5°
C3C4H42111.1°109.4°
H31C3H3298.4°109.4°
C5C4H41111.2°109.5°
C5C4H42111.1°109.5°
C4C5C6111.3°109.5°
C4C5H51111.5°109.5°
C4C5H52111.5°109.5°
H41C4H4299.3°109.4°
C6C5H51111.6°109.5°
C6C5H52111.6°109.5°
C5C6C7110.9°109.5°
C5C6H61111.6°109.4°
C5C6H62111.6°109.5°
H51C5H5298.8°109.4°
C7C6H61111.7°109.4°
C7C6H62111.7°109.5°
C6C7C8111.1°109.5°
C6C7H71111.6°109.4°
C6C7H72111.6°109.5°
H61C6H6298.7°109.5°
C8C7H71111.7°109.4°
C8C7H72111.6°109.5°
C7C8C9111.0°109.5°
C7C8H81111.6°109.5°
C7C8H82111.6°109.6°
H71C7H7298.8°109.5°
C9C8H81111.7°109.4°
C9C8H82111.7°109.5°
C8C9CA111.4°109.5°
C8C9H91111.5°109.4°
C8C9H92111.5°109.5°
H81C8H8298.8°109.5°
CAC9H91111.5°109.4°
CAC9H92111.6°109.5°
C9CACB111.9°109.5°
C9CAHA1111.3°109.5°
C9CAHA2111.3°109.5°
H91C9H9298.8°109.5°
CBCAHA1111.3°109.4°
CBCAHA2111.3°109.4°
CACBCC110.6°109.5°
CACBHB1111.8°109.4°
CACBHB2111.8°109.4°
HA1CAHA299.1°109.5°
CCCBHB1111.8°109.5°
CCCBHB2111.8°109.5°
CBCCCD112.0°109.5°
CBCCHC1111.3°109.4°
CBCCHC2111.2°109.5°
HB1CBHB298.5°109.5°
CDCCHC1111.3°109.4°
CDCCHC2111.3°109.5°
CCCDCE111.2°109.5°
CCCDHD1111.6°109.4°
CCCDHD2111.6°109.5°
HC1CCHC299.1°109.5°
CECDHD1111.6°109.4°
CECDHD2111.6°109.5°
CDCECF112.3°109.5°
CDCEHE1111.2°109.4°
CDCEHE2111.1°109.5°
HD1CDHD298.8°109.5°
CFCEHE1111.2°109.4°
CFCEHE2111.2°109.5°
CECFCG111.3°109.5°
CECFHF1111.5°109.4°
CECFHF2111.5°109.5°
HE1CEHE299.2°109.4°
CGCFHF1111.5°109.4°
CGCFHF2111.5°109.5°
CFCGHG1111.3°109.6°
CFCGHG2111.5°109.5°
CFCGHG3111.5°109.5°
HF1CFHF298.9°109.4°
HG1CGHG2111.6°109.4°
HG1CGHG3111.6°109.4°
HG2CGHG398.8°109.4°
Dihedrals
First atomSecond atomThird atomFourth atomTorsion
(experimental model)
Torsion
(ideal model)
O1C1O2C2179.1°179.9°
O1C1C2C3144.8°180.0°
O1C1C2H2119.5°60.1°
O1C1C2H2289.9°59.9°
O2C1O1H180.0°0.1°
O2C1C2C336.0°0.1°
O2C1C2H21161.3°120.0°
O2C1C2H2289.3°120.0°
C2C1O1H0.8°180.0°
C1C2C3H21125.2°120.0°
C1C2C3H22125.2°120.1°
C1C2H21H22116.5°120.1°
C1C2C3C4171.1°180.0°
C1C2C3H3145.8°60.0°
C1C2C3H3263.6°59.9°
C3C2H21H22116.6°119.9°
C2C3C4H31125.2°120.0°
C2C3C4H32125.3°120.1°
C2C3H31H32117.9°119.9°
C2C3C4C5176.1°180.0°
C2C3C4H4158.6°60.0°
C2C3C4H4250.9°59.9°
H21C2C3C463.7°60.0°
H21C2C3H31171.1°180.0°
H21C2C3H3261.6°60.1°
H22C2C3C445.9°59.9°
H22C2C3H3179.4°60.1°
H22C2C3H32171.2°180.0°
C4C3H31H32118.0°120.0°
C3C4C5H41125.3°120.0°
C3C4C5H42125.2°120.0°
C3C4H41H42116.9°119.9°
C3C4C5C685.1°180.0°
C3C4C5H51149.6°60.0°
C3C4C5H5240.2°60.0°
H31C3C4C550.9°60.0°
H31C3C4H41176.2°179.9°
H31C3C4H4274.3°60.0°
H32C3C4C558.6°60.0°
H32C3C4H4166.7°60.1°
H32C3C4H42176.1°180.0°
C5C4H41H42117.0°120.0°
C4C5C6H51125.3°120.1°
C4C5C6H52125.2°120.0°
C4C5H51H52117.4°120.0°
C4C5C6C765.6°180.0°
C4C5C6H61169.1°60.0°
C4C5C6H6259.7°60.0°
H41C4C5C640.1°60.0°
H41C4C5H5185.2°180.0°
H41C4C5H52165.4°60.1°
H42C4C5C6149.7°60.0°
H42C4C5H5124.4°60.1°
H42C4C5H5285.1°180.0°
C6C5H51H52117.5°119.9°
C5C6C7H61125.3°119.9°
C5C6C7H62125.2°120.0°
C5C6H61H62117.5°120.0°
C5C6C7C8173.7°180.0°
C5C6C7H7148.4°60.1°
C5C6C7H7261.1°59.9°
H51C5C6C759.7°60.0°
H51C5C6H6165.6°179.9°
H51C5C6H62175.1°60.1°
H52C5C6C7169.2°59.9°
H52C5C6H6143.9°60.0°
H52C5C6H6265.6°180.0°
C7C6H61H62117.6°120.0°
C6C7C8H71125.2°119.9°
C6C7C8H72125.3°120.1°
C6C7H71H72117.5°120.0°
C6C7C8C9175.5°180.0°
C6C7C8H8159.2°60.1°
C6C7C8H8250.3°59.9°
H61C6C7C861.1°60.1°
H61C6C7H71173.6°180.0°
H61C6C7H7264.2°60.0°
H62C6C7C848.4°59.9°
H62C6C7H7176.9°60.0°
H62C6C7H72173.7°180.0°
C8C7H71H72117.5°120.0°
C7C8C9H81125.2°119.9°
C7C8C9H82125.2°120.1°
C7C8H81H82117.5°120.1°
C7C8C9CA177.4°180.0°
C7C8C9H9152.1°60.1°
C7C8C9H9257.3°59.9°
H71C7C8C950.3°60.1°
H71C7C8H81175.6°180.0°
H71C7C8H8275.0°60.0°
H72C7C8C959.2°59.9°
H72C7C8H8166.1°60.0°
H72C7C8H82175.6°180.0°
C9C8H81H82117.6°119.9°
C8C9CAH91125.2°119.9°
C8C9CAH92125.3°120.1°
C8C9H91H92117.3°120.0°
C8C9CACB65.2°180.0°
C8C9CAHA1169.6°60.1°
C8C9CAHA260.0°60.0°
H81C8C9CA57.4°60.0°
H81C8C9H91177.3°180.0°
H81C8C9H9267.9°60.0°
H82C8C9CA52.2°59.9°
H82C8C9H9173.1°60.0°
H82C8C9H92177.5°180.0°
CAC9H91H92117.5°120.0°
C9CACBHA1125.2°120.0°
C9CACBHA2125.2°120.0°
C9CAHA1HA2117.2°120.0°
C9CACBCC170.5°180.0°
C9CACBHB145.2°60.0°
C9CACBHB264.2°60.0°
H91C9CACB60.0°60.0°
H91C9CAHA165.2°180.0°
H91C9CAHA2174.7°60.0°
H92C9CACB169.5°59.9°
H92C9CAHA144.3°60.0°
H92C9CAHA265.2°179.9°
CBCAHA1HA2117.2°119.9°
CACBCCHB1125.3°120.0°
CACBCCHB2125.3°120.0°
CACBHB1HB2117.7°119.9°
CACBCCCD170.4°180.0°
CACBCCHC145.1°60.0°
CACBCCHC264.4°59.9°
HA1CACBCC64.3°60.0°
HA1CACBHB1170.4°NaN°
HA1CACBHB261.0°60.1°
HA2CACBCC45.3°60.0°
HA2CACBHB180.0°60.1°
HA2CACBHB2170.6°180.0°
CCCBHB1HB2117.7°120.0°
CBCCCDHC1125.3°119.9°
CBCCCDHC2125.2°120.1°
CBCCHC1HC2117.1°120.0°
CBCCCDCE172.3°180.0°
CBCCCDHD147.0°60.1°
CBCCCDHD262.4°60.0°
HB1CBCCCD64.3°60.1°
HB1CBCCHC1170.4°180.0°
HB1CBCCHC260.9°60.0°
HB2CBCCCD45.1°60.0°
HB2CBCCHC180.2°60.0°
HB2CBCCHC2170.3°179.9°
CDCCHC1HC2117.2°120.0°
CCCDCEHD1125.3°119.9°
CCCDCEHD2125.3°120.1°
CCCDHD1HD2117.4°120.0°
CCCDCECF54.3°180.0°
CCCDCEHE171.0°60.0°
CCCDCEHE2179.6°59.9°
HC1CCCDCE62.4°60.1°
HC1CCCDHD1172.3°NaN°
HC1CCCDHD262.9°60.0°
HC2CCCDCE47.1°59.9°
HC2CCCDHD178.2°60.0°
HC2CCCDHD2172.4°180.0°
CECDHD1HD2117.5°120.0°
CDCECFHE1125.3°119.9°
CDCECFHE2125.2°120.1°
CDCEHE1HE2117.0°120.0°
CDCECFCG176.7°180.0°
CDCECFHF158.0°60.1°
CDCECFHF251.4°59.9°
HD1CDCECF179.6°60.1°
HD1CDCEHE154.3°180.0°
HD1CDCEHE255.1°60.1°
HD2CDCECF70.9°59.9°
HD2CDCEHE1163.8°60.1°
HD2CDCEHE254.3°180.0°
CFCEHE1HE2117.1°120.0°
CECFCGHF1125.2°120.0°
CECFCGHF2125.3°120.1°
CECFHF1HF2117.4°120.0°
CECFCGHG1180.0°180.0°
CECFCGHG254.7°60.0°
CECFCGHG354.7°60.0°
HE1CECFCG51.4°60.0°
HE1CECFHF1176.7°180.0°
HE1CECFHF273.8°60.1°
HE2CECFCG58.1°59.9°
HE2CECFHF167.2°60.1°
HE2CECFHF2176.6°NaN°
CGCFHF1HF2117.5°119.9°
CFCGHG1HG2125.3°120.1°
CFCGHG1HG3125.3°120.1°
CFCGHG2HG3117.4°120.0°
HF1CFCGHG154.8°60.0°
HF1CFCGHG2179.9°60.0°
HF1CFCGHG370.5°180.0°
HF2CFCGHG154.7°59.9°
HF2CFCGHG270.6°179.9°
HF2CFCGHG3180.0°60.1°
HG1CGHG2HG3117.5°119.9°

217705

PDB entries from 2024-03-27

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