LPA

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C2	C1	sing	1.51Å	1.54Å
C1	O2	doub	1.21Å	1.27Å
C1	O1	sing	1.34Å	1.28Å
O1	HO1	sing	0.97Å	0.95Å
C3	C2	sing	1.53Å	1.57Å
C2	H2	sing	1.09Å	1.10Å
C2	H2A	sing	1.09Å	1.10Å
C4	C3	sing	1.53Å	1.53Å
C3	H3	sing	1.09Å	1.10Å
C3	H3A	sing	1.09Å	1.10Å
C5	C4	sing	1.53Å	1.53Å
C4	H4	sing	1.09Å	1.10Å
C4	H4A	sing	1.09Å	1.10Å
C6	C5	sing	1.53Å	1.52Å
C5	H5	sing	1.09Å	1.10Å
C5	H5A	sing	1.09Å	1.10Å
C7	C6	sing	1.53Å	1.53Å
C6	S6	sing	1.83Å	1.76Å
C6	H6	sing	1.09Å	1.10Å
S8	S6	sing	2.07Å	2.00Å
C8	C7	sing	1.54Å	1.54Å
C7	H7	sing	1.09Å	1.10Å
C7	H7A	sing	1.09Å	1.10Å
C8	S8	sing	1.84Å	1.77Å
C8	H8	sing	1.09Å	1.10Å
C8	H8A	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C1	O2	115.8°	120.0°
C2	C1	O1	121.0°	120.0°
C1	C2	C3	103.1°	109.5°
C1	C2	H2	111.7°	109.5°
C1	C2	H2A	111.7°	109.5°
O2	C1	O1	123.2°	120.0°
C1	O1	HO1	109.5°	117.0°
C3	C2	H2	111.7°	109.5°
C3	C2	H2A	111.6°	109.5°
C2	C3	C4	104.9°	109.5°
C2	C3	H3	111.0°	109.4°
C2	C3	H3A	111.0°	109.5°
H2	C2	H2A	107.2°	109.4°
C4	C3	H3	111.0°	109.5°
C4	C3	H3A	111.0°	109.5°
C3	C4	C5	109.5°	109.5°
C3	C4	H4	109.5°	109.5°
C3	C4	H4A	109.5°	109.5°
H3	C3	H3A	107.9°	109.5°
C5	C4	H4	109.4°	109.4°
C5	C4	H4A	109.5°	109.5°
C4	C5	C6	113.8°	109.5°
C4	C5	H5	108.0°	109.5°
C4	C5	H5A	108.0°	109.5°
H4	C4	H4A	109.5°	109.5°
C6	C5	H5	108.0°	109.5°
C6	C5	H5A	108.0°	109.5°
C5	C6	C7	108.5°	109.6°
C5	C6	S6	110.4°	109.6°
C5	C6	H6	108.9°	109.6°
H5	C5	H5A	110.9°	109.4°
C7	C6	S6	107.6°	109.1°
C7	C6	H6	111.7°	109.4°
C6	C7	C8	117.5°	113.4°
C6	C7	H7	106.9°	108.8°
C6	C7	H7A	106.9°	108.7°
S6	C6	H6	109.7°	109.6°
C6	S6	S8	101.3°	97.4°
S6	S8	C8	99.0°	95.5°
C8	C7	H7	106.9°	108.7°
C8	C7	H7A	106.9°	108.5°
C7	C8	S8	109.0°	103.8°
C7	C8	H8	109.6°	110.6°
C7	C8	H8A	109.6°	110.6°
H7	C7	H7A	111.9°	108.6°
S8	C8	H8	109.7°	110.5°
S8	C8	H8A	109.6°	110.5°
H8	C8	H8A	109.3°	110.6°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C1	O2	O1	179.4°	179.7°
C2	C1	O1	HO1	179.4°	179.7°
C1	C2	C3	H2	120.0°	120.0°
C1	C2	C3	H2A	120.0°	120.0°
C1	C2	H2	H2A	122.6°	120.0°
C1	C2	C3	C4	110.8°	180.0°
C1	C2	C3	H3	129.2°	60.0°
C1	C2	C3	H3A	9.2°	60.0°
O2	C1	O1	HO1	0.0°	0.0°
O2	C1	C2	C3	125.8°	0.0°
O2	C1	C2	H2	114.2°	120.1°
O2	C1	C2	H2A	5.8°	120.0°
O1	C1	C2	C3	54.8°	179.7°
O1	C1	C2	H2	65.2°	60.2°
O1	C1	C2	H2A	174.7°	59.7°
C3	C2	H2	H2A	122.6°	120.0°
C2	C3	C4	H3	120.0°	120.0°
C2	C3	C4	H3A	120.0°	120.0°
C2	C3	H3	H3A	121.9°	120.0°
C2	C3	C4	C5	117.2°	180.0°
C2	C3	C4	H4	122.9°	60.0°
C2	C3	C4	H4A	2.9°	60.0°
H2	C2	C3	C4	9.2°	60.0°
H2	C2	C3	H3	110.8°	180.0°
H2	C2	C3	H3A	129.2°	60.1°
H2A	C2	C3	C4	129.2°	60.0°
H2A	C2	C3	H3	9.2°	60.0°
H2A	C2	C3	H3A	110.8°	NaN°
C4	C3	H3	H3A	121.9°	120.0°
C3	C4	C5	H4	120.0°	120.0°
C3	C4	C5	H4A	120.0°	120.0°
C3	C4	H4	H4A	120.0°	120.0°
C3	C4	C5	C6	127.2°	180.0°
C3	C4	C5	H5	7.2°	60.0°
C3	C4	C5	H5A	112.8°	60.0°
H3	C3	C4	C5	2.8°	60.0°
H3	C3	C4	H4	117.2°	180.0°
H3	C3	C4	H4A	122.8°	60.0°
H3A	C3	C4	C5	122.8°	60.0°
H3A	C3	C4	H4	2.8°	60.0°
H3A	C3	C4	H4A	117.2°	180.0°
C5	C4	H4	H4A	120.0°	120.0°
C4	C5	C6	H5	120.0°	120.0°
C4	C5	C6	H5A	120.0°	120.0°
C4	C5	H5	H5A	118.2°	120.0°
C4	C5	C6	C7	168.6°	173.9°
C4	C5	C6	S6	73.7°	66.5°
C4	C5	C6	H6	46.8°	53.8°
H4	C4	C5	C6	112.8°	60.0°
H4	C4	C5	H5	127.2°	180.0°
H4	C4	C5	H5A	7.2°	60.0°
H4A	C4	C5	C6	7.2°	60.0°
H4A	C4	C5	H5	112.8°	60.1°
H4A	C4	C5	H5A	127.2°	180.0°
C6	C5	H5	H5A	118.2°	120.0°
C5	C6	C7	S6	119.5°	119.9°
C5	C6	C7	H6	120.0°	120.2°
C5	C6	S6	H6	120.1°	120.3°
C5	C6	S6	S8	104.8°	123.2°
C5	C6	C7	C8	94.0°	153.4°
C5	C6	C7	H7	26.0°	32.3°
C5	C6	C7	H7A	146.0°	85.8°
H5	C5	C6	C7	71.4°	66.0°
H5	C5	C6	S6	46.2°	53.6°
H5	C5	C6	H6	166.8°	173.9°
H5A	C5	C6	C7	48.6°	53.9°
H5A	C5	C6	S6	166.3°	173.5°
H5A	C5	C6	H6	73.2°	66.2°
C7	C6	S6	H6	121.7°	119.8°
C7	C6	S6	S8	13.4°	3.3°
C6	C7	C8	H7	120.0°	121.1°
C6	C7	C8	H7A	120.0°	120.9°
C6	C7	H7	H7A	116.7°	118.2°
C6	C7	C8	S8	25.6°	49.7°
C6	C7	C8	H8	94.4°	168.3°
C6	C7	C8	H8A	145.6°	68.9°
S6	C6	C7	C8	25.5°	33.5°
S6	C6	C7	H7	145.5°	87.6°
S6	C6	C7	H7A	94.5°	154.3°
C6	S6	S8	C8	0.3°	20.4°
H6	C6	S6	S8	135.1°	116.5°
H6	C6	C7	C8	146.0°	86.4°
H6	C6	C7	H7	94.0°	152.5°
H6	C6	C7	H7A	26.0°	34.4°
S6	S8	C8	C7	12.9°	39.3°
S6	S8	C8	H8	107.1°	157.9°
S6	S8	C8	H8A	132.9°	79.3°
C8	C7	H7	H7A	116.7°	117.9°
C7	C8	S8	H8	120.0°	118.6°
C7	C8	S8	H8A	120.0°	118.6°
C7	C8	H8	H8A	120.2°	122.8°
H7	C7	C8	S8	145.6°	71.4°
H7	C7	C8	H8	25.6°	47.1°
H7	C7	C8	H8A	94.4°	170.0°
H7A	C7	C8	S8	94.4°	170.6°
H7A	C7	C8	H8	145.6°	70.8°
H7A	C7	C8	H8A	25.6°	52.1°
S8	C8	H8	H8A	120.2°	122.8°

Definition date:	1999-07-08
Last modified:	2020-06-17
Release status:	REL
Processing site:	RCSB
Derived from:	1X2H