1AR

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O1	C1	sing	1.43Å	1.45Å
O1	HO1	sing	0.97Å	0.95Å
C1	C2	sing	1.53Å	1.52Å
C1	O5	sing	1.43Å	1.44Å
C1	H1	sing	1.09Å	1.11Å
C2	C3	sing	1.53Å	1.52Å
C2	H21	sing	1.09Å	1.11Å
C2	H22	sing	1.09Å	1.11Å
C3	O3	sing	1.43Å	1.41Å
C3	CC3	sing	1.53Å	1.52Å
C3	C4	sing	1.53Å	1.54Å
O3	HO3	sing	0.97Å	0.97Å
CC3	HM31	sing	1.09Å	1.11Å
CC3	HM32	sing	1.09Å	1.11Å
CC3	HM33	sing	1.09Å	1.11Å
C4	O4	sing	1.45Å	1.48Å
C4	C5	sing	1.53Å	1.53Å
C4	H4	sing	1.09Å	1.11Å
O4	CO4	sing	1.34Å	1.36Å
CME	CO4	sing	1.51Å	1.51Å
CME	HM41	sing	1.09Å	1.11Å
CME	HM42	sing	1.09Å	1.11Å
CME	HM43	sing	1.09Å	1.11Å
CO4	OC4	doub	1.21Å	1.22Å
C5	O5	sing	1.43Å	3.01Å
C5	C6	sing	1.53Å	1.51Å
C5	H5	sing	1.09Å	1.11Å
C6	H61	sing	1.09Å	1.11Å
C6	H62	sing	1.09Å	1.11Å
C6	H63	sing	1.09Å	1.11Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C1	O1	HO1	106.7°	106.9°
O1	C1	C2	106.7°	109.4°
O1	C1	O5	118.3°	109.4°
O1	C1	H1	105.2°	109.4°
C2	C1	O5	105.2°	109.8°
C2	C1	H1	115.7°	109.3°
C1	C2	C3	116.0°	109.0°
C1	C2	H21	105.8°	109.5°
C1	C2	H22	108.3°	109.6°
O5	C1	H1	106.2°	109.4°
C1	O5	C5	53.1°	107.6°
C3	C2	H21	107.8°	109.5°
C3	C2	H22	110.2°	109.6°
C2	C3	O3	107.3°	109.6°
C2	C3	CC3	112.4°	109.6°
C2	C3	C4	108.4°	108.6°
H21	C2	H22	108.4°	109.7°
O3	C3	CC3	105.5°	109.6°
O3	C3	C4	111.0°	109.7°
C3	O3	HO3	105.0°	106.8°
CC3	C3	C4	112.1°	109.7°
C3	CC3	HM31	110.1°	109.4°
C3	CC3	HM32	112.4°	109.5°
C3	CC3	HM33	109.9°	109.5°
C3	C4	O4	113.9°	109.5°
C3	C4	C5	109.7°	109.1°
C3	C4	H4	106.5°	109.6°
HM31	CC3	HM32	108.0°	109.5°
HM31	CC3	HM33	108.9°	109.4°
HM32	CC3	HM33	107.5°	109.5°
O4	C4	C5	108.6°	109.5°
O4	C4	H4	110.8°	109.5°
C4	O4	CO4	117.0°	120.1°
C5	C4	H4	107.0°	109.6°
C4	C5	O5	101.8°	109.8°
C4	C5	C6	108.7°	109.5°
C4	C5	H5	112.7°	109.4°
O4	CO4	CME	108.5°	120.1°
O4	CO4	OC4	126.1°	120.0°
CO4	CME	HM41	108.4°	109.5°
CO4	CME	HM42	111.4°	109.5°
CO4	CME	HM43	109.4°	109.5°
CME	CO4	OC4	122.7°	120.0°
HM41	CME	HM42	109.8°	109.4°
HM41	CME	HM43	108.0°	109.5°
HM42	CME	HM43	109.7°	109.4°
O5	C5	C6	148.4°	109.4°
O5	C5	H5	62.1°	109.3°
C6	C5	H5	111.4°	109.4°
C5	C6	H61	111.1°	109.5°
C5	C6	H62	109.9°	109.5°
C5	C6	H63	111.2°	109.5°
H61	C6	H62	108.1°	109.5°
H61	C6	H63	108.7°	109.4°
H62	C6	H63	107.8°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	C1	C2	O5	126.6°	120.1°
O1	C1	C2	H1	116.6°	119.8°
O1	C1	O5	H1	117.8°	119.9°
O1	C1	C2	C3	52.6°	178.7°
O1	C1	C2	H21	66.8°	61.5°
O1	C1	C2	H22	177.1°	58.8°
O1	C1	O5	C5	28.0°	172.4°
HO1	O1	C1	C2	180.0°	179.7°
HO1	O1	C1	O5	61.7°	59.9°
HO1	O1	C1	H1	56.6°	59.9°
C2	C1	O5	H1	123.1°	120.0°
C1	C2	C3	H21	118.3°	119.8°
C1	C2	C3	H22	123.6°	119.9°
C1	C2	H21	H22	116.0°	120.3°
C1	C2	C3	O3	171.0°	173.6°
C1	C2	C3	CC3	73.4°	66.0°
C1	C2	C3	C4	51.1°	53.7°
C2	C1	O5	C5	91.1°	67.5°
O5	C1	C2	C3	73.9°	61.2°
O5	C1	C2	H21	166.6°	58.6°
O5	C1	C2	H22	50.6°	178.9°
C1	O5	C5	C4	74.1°	67.5°
C1	O5	C5	C6	90.5°	172.3°
C1	O5	C5	H5	176.3°	52.5°
H1	C1	C2	C3	169.2°	58.9°
H1	C1	C2	H21	49.8°	178.7°
H1	C1	C2	H22	66.2°	61.0°
H1	C1	O5	C5	145.8°	52.5°
C3	C2	H21	H22	119.3°	120.3°
C2	C3	O3	CC3	120.1°	120.3°
C2	C3	O3	C4	118.3°	119.2°
C2	C3	CC3	C4	122.5°	119.1°
C2	C3	O3	HO3	47.6°	60.0°
C2	C3	CC3	HM31	51.9°	60.0°
C2	C3	CC3	HM32	68.5°	60.0°
C2	C3	CC3	HM33	171.9°	179.9°
C2	C3	C4	O4	174.7°	173.7°
C2	C3	C4	C5	52.6°	53.8°
C2	C3	C4	H4	62.9°	66.2°
H21	C2	C3	O3	52.7°	53.8°
H21	C2	C3	CC3	168.3°	174.2°
H21	C2	C3	C4	67.3°	66.0°
H22	C2	C3	O3	65.4°	66.5°
H22	C2	C3	CC3	50.1°	53.8°
H22	C2	C3	C4	174.6°	173.6°
O3	C3	CC3	C4	120.9°	120.5°
O3	C3	CC3	HM31	64.7°	60.3°
O3	C3	CC3	HM32	174.9°	179.7°
O3	C3	CC3	HM33	55.2°	59.6°
O3	C3	C4	O4	67.7°	66.5°
O3	C3	C4	C5	170.3°	173.6°
O3	C3	C4	H4	54.8°	53.6°
CC3	C3	O3	HO3	72.4°	60.3°
C3	CC3	HM31	HM32	123.0°	120.0°
C3	CC3	HM31	HM33	120.5°	120.0°
C3	CC3	HM32	HM33	121.0°	120.1°
CC3	C3	C4	O4	50.0°	53.9°
CC3	C3	C4	C5	72.0°	65.9°
CC3	C3	C4	H4	172.4°	174.1°
C4	C3	O3	HO3	165.9°	179.2°
C4	C3	CC3	HM31	174.4°	179.2°
C4	C3	CC3	HM32	54.0°	59.2°
C4	C3	CC3	HM33	65.7°	60.9°
C3	C4	O4	C5	122.6°	119.6°
C3	C4	O4	H4	120.1°	120.2°
C3	C4	C5	H4	115.2°	120.0°
C3	C4	O4	CO4	118.5°	150.0°
C3	C4	C5	O5	3.0°	61.3°
C3	C4	C5	C6	174.6°	178.6°
C3	C4	C5	H5	61.5°	58.7°
HM31	CC3	HM32	HM33	117.4°	120.0°
O4	C4	C5	H4	119.7°	120.2°
C4	O4	CO4	CME	150.0°	180.0°
C4	O4	CO4	OC4	11.7°	0.0°
O4	C4	C5	O5	128.1°	178.8°
O4	C4	C5	C6	60.4°	58.7°
O4	C4	C5	H5	63.6°	61.2°
C5	C4	O4	CO4	118.9°	90.4°
C4	C5	O5	C6	164.6°	120.2°
C4	C5	O5	H5	109.7°	120.0°
C4	C5	C6	H5	124.8°	119.9°
C4	C5	C6	H61	70.8°	179.8°
C4	C5	C6	H62	169.7°	60.2°
C4	C5	C6	H63	50.4°	59.9°
H4	C4	O4	CO4	1.6°	29.8°
H4	C4	C5	O5	112.2°	58.7°
H4	C4	C5	C6	59.4°	61.5°
H4	C4	C5	H5	176.7°	178.7°
O4	CO4	CME	OC4	162.4°	180.0°
O4	CO4	CME	HM41	176.2°	180.0°
O4	CO4	CME	HM42	55.2°	60.0°
O4	CO4	CME	HM43	66.3°	60.0°
CO4	CME	HM41	HM42	121.9°	120.0°
CO4	CME	HM41	HM43	118.4°	120.1°
CO4	CME	HM42	HM43	121.3°	120.0°
HM41	CME	HM42	HM43	118.6°	120.0°
HM41	CME	CO4	OC4	21.5°	0.0°
HM42	CME	CO4	OC4	142.4°	120.0°
HM43	CME	CO4	OC4	96.1°	120.1°
O5	C5	C6	H5	71.1°	119.8°
O5	C5	C6	H61	125.2°	59.8°
O5	C5	C6	H62	5.6°	60.2°
O5	C5	C6	H63	113.7°	179.8°
C5	C6	H61	H62	120.6°	120.0°
C5	C6	H61	H63	122.6°	120.0°
C5	C6	H62	H63	121.3°	120.0°
H5	C5	C6	H61	54.0°	59.9°
H5	C5	C6	H62	65.5°	180.0°
H5	C5	C6	H63	175.2°	60.0°
H61	C6	H62	H63	117.3°	120.0°

Definition date:	1999-07-08
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB