LSO

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O	C	doub	1.22Å	1.21Å
C	CA	sing	1.52Å	1.54Å
C	OXT	sing	1.36Å	123.54Å
CA	N	sing	1.46Å	1.47Å
CA	CB	sing	1.54Å	1.52Å
CA	HA	sing	1.10Å	1.10Å
N	H	sing	1.00Å	1.00Å
N	H2	sing	1.00Å	1.00Å
CB	CG	sing	1.54Å	1.52Å
CB	HBC1	sing	1.10Å	1.10Å
CB	HBC2	sing	1.10Å	1.10Å
CG	CD	sing	1.53Å	1.51Å
CG	HGC1	sing	1.10Å	1.10Å
CG	HGC2	sing	1.10Å	1.10Å
CD	CE	sing	1.52Å	1.51Å
CD	HDC1	sing	1.10Å	1.10Å
CD	HDC2	sing	1.10Å	1.10Å
CE	NZ	sing	1.45Å	1.44Å
CE	HEC1	sing	1.10Å	1.10Å
CE	HEC2	sing	1.10Å	1.10Å
NZ	C4	doub	1.29Å	1.28Å
C4	C3	sing	1.52Å	1.52Å
C4	C5	sing	1.51Å	1.52Å
C3	C2	sing	1.53Å	1.53Å
C3	H3C1	sing	1.09Å	1.10Å
C3	H3C2	sing	1.09Å	1.10Å
C2	C1	sing	1.51Å	1.51Å
C2	H2C1	sing	1.10Å	1.10Å
C2	H2C2	sing	1.10Å	1.10Å
C1	O2	sing	1.36Å	1.26Å
C1	O1	doub	1.22Å	1.26Å
O2	H1	sing	0.98Å	0.95Å
C5	S6	sing	1.76Å	1.69Å
C5	H5C1	sing	1.09Å	1.10Å
C5	H5C2	sing	1.09Å	1.10Å
S6	O6	doub	1.45Å	1.45Å
S6	O5	doub	1.45Å	1.46Å
S6	C7	sing	1.78Å	1.68Å
C7	C8	sing	1.51Å	1.52Å
C7	H7C1	sing	1.09Å	1.10Å
C7	H7C2	sing	1.09Å	1.10Å
C8	O7	doub	1.23Å	1.21Å
C8	C9	sing	1.52Å	1.51Å
C9	C10	sing	1.52Å	1.54Å
C9	H9C1	sing	1.10Å	1.10Å
C9	H9C2	sing	1.10Å	1.10Å
C10	C11	sing	1.51Å	1.53Å
C10	H101	sing	1.10Å	1.10Å
C10	H102	sing	1.09Å	1.10Å
C11	O3	doub	1.22Å	1.25Å
C11	O4	sing	1.36Å	1.25Å
O4	H4	sing	0.98Å	0.95Å
OXT	HXT	sing	0.98Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O	C	CA	113.0°	126.3°
O	C	OXT	67.6°	123.2°
CA	C	OXT	154.3°	110.5°
C	CA	N	109.8°	108.2°
C	CA	CB	115.7°	112.2°
C	CA	HA	105.0°	107.5°
C	OXT	HXT	67.6°	111.9°
N	CA	CB	110.2°	111.5°
N	CA	HA	111.2°	107.8°
CA	N	H	109.5°	118.0°
CA	N	H2	109.5°	117.9°
CB	CA	HA	104.7°	109.4°
CA	CB	CG	109.9°	114.5°
CA	CB	HBC1	109.3°	109.1°
CA	CB	HBC2	109.4°	108.9°
H	N	H2	109.5°	122.6°
CG	CB	HBC1	109.2°	108.8°
CG	CB	HBC2	109.3°	109.0°
CB	CG	CD	107.2°	111.0°
CB	CG	HGC1	110.7°	109.8°
CB	CG	HGC2	110.2°	109.9°
HBC1	CB	HBC2	109.8°	106.3°
CD	CG	HGC1	110.7°	109.5°
CD	CG	HGC2	110.2°	109.2°
CG	CD	CE	106.5°	112.5°
CG	CD	HDC1	111.2°	109.1°
CG	CD	HDC2	110.5°	109.6°
HGC1	CG	HGC2	107.7°	107.3°
CE	CD	HDC1	111.2°	108.6°
CE	CD	HDC2	110.5°	109.7°
CD	CE	NZ	106.8°	109.9°
CD	CE	HEC1	111.0°	110.9°
CD	CE	HEC2	110.4°	109.7°
HDC1	CD	HDC2	107.1°	107.1°
NZ	CE	HEC1	111.0°	109.7°
NZ	CE	HEC2	110.4°	108.8°
CE	NZ	C4	124.2°	119.6°
HEC1	CE	HEC2	107.4°	107.9°
NZ	C4	C3	118.4°	125.4°
NZ	C4	C5	121.2°	117.2°
C3	C4	C5	120.4°	117.4°
C4	C3	C2	109.3°	111.0°
C4	C3	H3C1	109.5°	109.0°
C4	C3	H3C2	109.5°	108.9°
C4	C5	S6	118.3°	110.2°
C4	C5	H5C1	104.6°	110.6°
C4	C5	H5C2	106.6°	111.0°
C2	C3	H3C1	109.5°	112.4°
C2	C3	H3C2	109.5°	109.5°
C3	C2	C1	110.6°	113.5°
C3	C2	H2C1	108.9°	108.4°
C3	C2	H2C2	109.1°	111.2°
H3C1	C3	H3C2	109.4°	105.9°
C1	C2	H2C1	108.9°	106.4°
C1	C2	H2C2	109.1°	108.3°
C2	C1	O2	120.4°	111.3°
C2	C1	O1	115.6°	125.9°
H2C1	C2	H2C2	110.3°	108.8°
O2	C1	O1	124.1°	122.9°
C1	O2	H1	109.5°	115.0°
S6	C5	H5C1	104.6°	107.4°
S6	C5	H5C2	106.6°	108.1°
C5	S6	O6	111.3°	108.4°
C5	S6	O5	105.2°	108.4°
C5	S6	C7	110.8°	103.4°
H5C1	C5	H5C2	116.7°	109.4°
O6	S6	O5	111.5°	120.4°
O6	S6	C7	110.1°	107.5°
O5	S6	C7	107.9°	107.5°
S6	C7	C8	115.3°	112.6°
S6	C7	H7C1	106.2°	107.2°
S6	C7	H7C2	107.5°	107.3°
C8	C7	H7C1	106.2°	109.7°
C8	C7	H7C2	107.6°	109.6°
C7	C8	O7	119.9°	122.4°
C7	C8	C9	121.3°	115.3°
H7C1	C7	H7C2	114.2°	110.4°
O7	C8	C9	118.7°	122.3°
C8	C9	C10	110.2°	113.8°
C8	C9	H9C1	109.1°	108.2°
C8	C9	H9C2	109.2°	106.4°
C10	C9	H9C1	109.1°	111.1°
C10	C9	H9C2	109.2°	108.7°
C9	C10	C11	113.2°	111.3°
C9	C10	H101	107.4°	109.3°
C9	C10	H102	108.2°	113.7°
H9C1	C9	H9C2	110.0°	108.4°
C11	C10	H101	107.4°	106.3°
C11	C10	H102	108.2°	109.9°
C10	C11	O3	119.0°	124.0°
C10	C11	O4	120.4°	112.6°
H101	C10	H102	112.5°	105.9°
O3	C11	O4	120.6°	123.4°
C11	O4	H4	109.5°	115.1°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O	C	CA	OXT	85.9°	179.3°
O	C	CA	N	54.7°	3.8°
O	C	CA	CB	70.7°	119.7°
O	C	CA	HA	174.4°	120.0°
O	C	OXT	HXT	180.0°	0.0°
C	CA	N	CB	128.6°	123.9°
C	CA	N	HA	115.8°	116.1°
C	CA	CB	HA	115.1°	119.2°
C	CA	N	H	127.0°	86.6°
C	CA	N	H2	113.0°	106.7°
C	CA	CB	CG	58.0°	177.8°
C	CA	CB	HBC1	61.9°	60.0°
C	CA	CB	HBC2	178.0°	55.6°
CA	C	OXT	HXT	83.2°	179.3°
OXT	C	CA	N	140.6°	175.5°
OXT	C	CA	CB	15.1°	61.1°
OXT	C	CA	HA	99.8°	59.2°
N	CA	CB	HA	119.6°	119.1°
CA	N	H	H2	120.0°	166.0°
N	CA	CB	CG	176.7°	60.6°
N	CA	CB	HBC1	63.5°	61.6°
N	CA	CB	HBC2	56.7°	177.2°
CB	CA	N	H	104.5°	149.5°
CB	CA	N	H2	15.5°	17.2°
CA	CB	CG	HBC1	119.8°	122.3°
CA	CB	CG	HBC2	120.0°	122.2°
CA	CB	HBC1	HBC2	119.9°	117.2°
CA	CB	CG	CD	179.5°	177.6°
CA	CB	CG	HGC1	59.6°	56.3°
CA	CB	CG	HGC2	59.5°	61.5°
HA	CA	N	H	11.1°	29.5°
HA	CA	N	H2	131.1°	137.2°
HA	CA	CB	CG	57.1°	58.6°
HA	CA	CB	HBC1	176.9°	179.3°
HA	CA	CB	HBC2	62.9°	63.7°
CG	CB	HBC1	HBC2	119.9°	117.2°
CB	CG	CD	HGC1	120.9°	121.5°
CB	CG	CD	HGC2	120.0°	121.3°
CB	CG	HGC1	HGC2	120.6°	119.4°
CB	CG	CD	CE	172.7°	179.4°
CB	CG	CD	HDC1	66.1°	60.0°
CB	CG	CD	HDC2	52.7°	57.1°
HBC1	CB	CG	CD	59.7°	60.0°
HBC1	CB	CG	HGC1	179.5°	178.6°
HBC1	CB	CG	HGC2	60.3°	60.9°
HBC2	CB	CG	CD	60.5°	55.4°
HBC2	CB	CG	HGC1	60.4°	65.9°
HBC2	CB	CG	HGC2	179.5°	176.3°
CD	CG	HGC1	HGC2	120.6°	118.4°
CG	CD	CE	HDC1	121.2°	120.9°
CG	CD	CE	HDC2	120.0°	122.3°
CG	CD	HDC1	HDC2	120.8°	118.6°
CG	CD	CE	NZ	176.1°	61.4°
CG	CD	CE	HEC1	55.1°	60.0°
CG	CD	CE	HEC2	63.9°	179.1°
HGC1	CG	CD	CE	51.8°	57.9°
HGC1	CG	CD	HDC1	173.0°	178.5°
HGC1	CG	CD	HDC2	68.2°	64.4°
HGC2	CG	CD	CE	67.4°	59.3°
HGC2	CG	CD	HDC1	53.8°	61.3°
HGC2	CG	CD	HDC2	172.7°	178.4°
CE	CD	HDC1	HDC2	120.8°	118.5°
CD	CE	NZ	HEC1	121.0°	122.2°
CD	CE	NZ	HEC2	120.0°	120.1°
CD	CE	HEC1	HEC2	120.8°	120.2°
CD	CE	NZ	C4	157.1°	177.8°
HDC1	CD	CE	NZ	62.7°	177.7°
HDC1	CD	CE	HEC1	176.3°	60.9°
HDC1	CD	CE	HEC2	57.3°	58.2°
HDC2	CD	CE	NZ	56.1°	60.9°
HDC2	CD	CE	HEC1	64.9°	177.7°
HDC2	CD	CE	HEC2	176.1°	58.6°
NZ	CE	HEC1	HEC2	120.7°	118.3°
CE	NZ	C4	C3	2.2°	0.1°
CE	NZ	C4	C5	179.9°	179.6°
HEC1	CE	NZ	C4	36.1°	60.0°
HEC2	CE	NZ	C4	82.9°	57.7°
NZ	C4	C3	C5	178.0°	179.8°
NZ	C4	C3	C2	90.0°	94.5°
NZ	C4	C3	H3C1	149.9°	29.8°
NZ	C4	C3	H3C2	30.0°	144.9°
NZ	C4	C5	S6	27.3°	91.2°
NZ	C4	C5	H5C1	88.5°	150.2°
NZ	C4	C5	H5C2	147.3°	28.6°
C4	C3	C2	H3C1	120.0°	122.4°
C4	C3	C2	H3C2	120.0°	120.3°
C4	C3	H3C1	H3C2	120.0°	117.0°
C4	C3	C2	C1	175.8°	178.1°
C4	C3	C2	H2C1	56.3°	60.1°
C4	C3	C2	H2C2	64.2°	59.5°
C3	C4	C5	S6	154.8°	88.6°
C3	C4	C5	H5C1	89.4°	30.0°
C3	C4	C5	H5C2	34.8°	151.6°
C5	C4	C3	C2	92.0°	85.7°
C5	C4	C3	H3C1	28.0°	150.0°
C5	C4	C3	H3C2	148.0°	34.9°
C4	C5	S6	H5C1	115.8°	120.6°
C4	C5	S6	H5C2	120.0°	121.5°
C4	C5	H5C1	H5C2	117.5°	122.5°
C4	C5	S6	O6	33.9°	66.1°
C4	C5	S6	O5	154.7°	66.1°
C4	C5	S6	C7	88.9°	180.0°
C2	C3	H3C1	H3C2	120.1°	119.5°
C3	C2	C1	H2C1	119.5°	119.2°
C3	C2	C1	H2C2	120.0°	124.0°
C3	C2	H2C1	H2C2	119.7°	121.0°
C3	C2	C1	O2	18.7°	178.8°
C3	C2	C1	O1	161.4°	0.9°
H3C1	C3	C2	C1	64.1°	59.5°
H3C1	C3	C2	H2C1	176.3°	177.6°
H3C1	C3	C2	H2C2	55.9°	62.9°
H3C2	C3	C2	C1	55.8°	57.8°
H3C2	C3	C2	H2C1	63.7°	60.2°
H3C2	C3	C2	H2C2	175.8°	179.7°
C1	C2	H2C1	H2C2	119.7°	116.5°
C2	C1	O2	O1	179.9°	179.7°
C2	C1	O2	H1	179.9°	179.7°
H2C1	C2	C1	O2	138.3°	59.7°
H2C1	C2	C1	O1	41.8°	120.0°
H2C2	C2	C1	O2	101.3°	57.1°
H2C2	C2	C1	O1	78.6°	123.2°
O1	C1	O2	H1	0.0°	0.1°
S6	C5	H5C1	H5C2	117.5°	117.1°
C5	S6	O6	O5	117.1°	125.4°
C5	S6	O6	C7	123.3°	111.2°
C5	S6	O5	C7	118.3°	111.2°
C5	S6	C7	C8	59.6°	180.0°
C5	S6	C7	H7C1	177.0°	59.3°
C5	S6	C7	H7C2	60.4°	59.3°
H5C1	C5	S6	O6	81.9°	54.4°
H5C1	C5	S6	O5	38.9°	173.3°
H5C1	C5	S6	C7	155.3°	59.4°
H5C2	C5	S6	O6	153.9°	172.4°
H5C2	C5	S6	O5	85.3°	55.4°
H5C2	C5	S6	C7	31.1°	58.5°
O6	S6	O5	C7	120.9°	123.4°
O6	S6	C7	C8	63.9°	65.5°
O6	S6	C7	H7C1	53.4°	55.2°
O6	S6	C7	H7C2	176.1°	173.8°
O5	S6	C7	C8	174.3°	65.5°
O5	S6	C7	H7C1	68.4°	173.8°
O5	S6	C7	H7C2	54.3°	55.2°
S6	C7	C8	H7C1	117.3°	119.3°
S6	C7	C8	H7C2	120.0°	119.4°
S6	C7	H7C1	H7C2	118.3°	116.6°
S6	C7	C8	O7	31.4°	0.8°
S6	C7	C8	C9	149.1°	179.3°
C8	C7	H7C1	H7C2	118.4°	120.9°
C7	C8	O7	C9	179.5°	179.9°
C7	C8	C9	C10	150.6°	176.0°
C7	C8	C9	H9C1	30.9°	60.0°
C7	C8	C9	H9C2	89.4°	56.4°
H7C1	C7	C8	O7	85.9°	120.2°
H7C1	C7	C8	C9	93.5°	59.9°
H7C2	C7	C8	O7	151.4°	118.5°
H7C2	C7	C8	C9	29.2°	61.4°
O7	C8	C9	C10	28.8°	3.9°
O7	C8	C9	H9C1	148.6°	120.1°
O7	C8	C9	H9C2	91.2°	123.5°
C8	C9	C10	H9C1	119.7°	122.5°
C8	C9	C10	H9C2	120.0°	118.3°
C8	C9	H9C1	H9C2	119.8°	115.0°
C8	C9	C10	C11	66.1°	177.1°
C8	C9	C10	H101	175.6°	60.0°
C8	C9	C10	H102	53.9°	58.1°
C10	C9	H9C1	H9C2	119.8°	119.4°
C9	C10	C11	H101	118.3°	118.9°
C9	C10	C11	H102	120.0°	126.9°
C9	C10	H101	H102	119.0°	122.9°
C9	C10	C11	O3	160.6°	1.1°
C9	C10	C11	O4	19.6°	179.7°
H9C1	C9	C10	C11	53.6°	60.4°
H9C1	C9	C10	H101	64.7°	177.5°
H9C1	C9	C10	H102	173.6°	64.4°
H9C2	C9	C10	C11	173.9°	58.8°
H9C2	C9	C10	H101	55.5°	58.3°
H9C2	C9	C10	H102	66.1°	176.4°
C11	C10	H101	H102	118.9°	116.9°
C10	C11	O3	O4	179.8°	179.1°
C10	C11	O4	H4	179.8°	179.1°
H101	C10	C11	O3	42.3°	120.0°
H101	C10	C11	O4	137.9°	60.8°
H102	C10	C11	O3	79.4°	125.8°
H102	C10	C11	O4	100.4°	53.4°
O3	C11	O4	H4	0.0°	0.1°

Definition date:	2005-09-11
Last modified:	2024-09-27
Release status:	REL
Processing site:	EBI
Derived from:	2C18