Obsolete: BTU

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
OAB	CAJ	sing	1.43Å	1.46Å
CAJ	CAT	sing	1.53Å	1.55Å
OAH	CAW	sing	1.43Å	1.46Å
OAN	CAT	sing	1.44Å	1.44Å
OAN	CAW	sing	1.43Å	1.48Å
CAT	CAR	sing	1.55Å	1.55Å
OAC	CAK	sing	1.43Å	1.45Å
CAW	CAK	sing	1.53Å	1.53Å
CAW	CAV	sing	1.54Å	1.52Å
CAR	CAV	sing	1.55Å	1.51Å
CAR	OAG	sing	1.43Å	1.39Å
O4	C4	sing	1.43Å	1.41Å
O1	CAV	sing	1.43Å	1.48Å
O1	C1	sing	1.43Å	1.46Å
C3	C4	sing	1.53Å	1.55Å
C3	O3	sing	1.43Å	1.47Å
C3	C2	sing	1.53Å	1.54Å
C5	C6	sing	1.53Å	1.54Å
C5	C4	sing	1.53Å	1.56Å
C5	O5	sing	1.43Å	1.46Å
C6	O6	sing	1.43Å	1.41Å
O2	C2	sing	1.43Å	1.45Å
C1	C2	sing	1.53Å	1.56Å
C1	O5	sing	1.43Å	1.46Å
C1	H1	sing	1.09Å	1.10Å
C2	H2	sing	1.09Å	1.10Å
O2	HO2	sing	0.97Å	0.95Å
C3	H3	sing	1.09Å	1.10Å
O3	HO3	sing	0.97Å	0.95Å
C4	H4	sing	1.09Å	1.10Å
O4	HO4	sing	0.97Å	0.95Å
C5	H5	sing	1.09Å	1.10Å
C6	H6A	sing	1.09Å	1.10Å
C6	H6	sing	1.09Å	1.10Å
O6	HO6	sing	0.97Å	0.95Å
OAB	HOAB	sing	0.97Å	0.95Å
OAC	HOAC	sing	0.97Å	0.95Å
OAG	HOAG	sing	0.97Å	0.95Å
OAH	HOAH	sing	0.97Å	0.95Å
CAJ	HAJ	sing	1.09Å	1.10Å
CAJ	HAJA	sing	1.09Å	1.10Å
CAK	HAK	sing	1.09Å	1.10Å
CAK	HAKA	sing	1.09Å	1.10Å
CAR	HAR	sing	1.09Å	1.10Å
CAT	HAT	sing	1.09Å	1.10Å
CAV	HAV	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
OAB	CAJ	CAT	111.2°	109.5°
CAJ	OAB	HOAB	109.5°	114.0°
OAB	CAJ	HAJ	109.0°	109.5°
OAB	CAJ	HAJA	109.0°	109.5°
CAJ	CAT	OAN	100.4°	110.3°
CAJ	CAT	CAR	118.5°	110.3°
CAT	CAJ	HAJ	109.0°	109.5°
CAT	CAJ	HAJA	109.0°	109.4°
CAJ	CAT	HAT	110.2°	110.3°
OAH	CAW	OAN	112.0°	109.9°
OAH	CAW	CAK	109.9°	109.8°
OAH	CAW	CAV	107.8°	109.8°
CAW	OAH	HOAH	109.5°	113.9°
CAT	OAN	CAW	108.1°	110.0°
OAN	CAT	CAR	105.0°	105.1°
OAN	CAT	HAT	112.0°	110.3°
OAN	CAW	CAK	107.3°	109.9°
OAN	CAW	CAV	105.9°	107.6°
CAT	CAR	CAV	103.7°	100.9°
CAT	CAR	OAG	110.9°	111.1°
CAT	CAR	HAR	110.7°	111.2°
CAR	CAT	HAT	110.3°	110.4°
OAC	CAK	CAW	108.5°	109.4°
CAK	OAC	HOAC	109.5°	113.9°
OAC	CAK	HAK	109.7°	109.5°
OAC	CAK	HAKA	109.7°	109.5°
CAK	CAW	CAV	114.0°	109.9°
CAW	CAK	HAK	109.7°	109.5°
CAW	CAK	HAKA	109.7°	109.4°
CAW	CAV	CAR	98.6°	102.3°
CAW	CAV	O1	109.6°	110.9°
CAW	CAV	HAV	113.0°	111.0°
CAV	CAR	OAG	106.8°	111.1°
CAR	CAV	O1	107.8°	110.8°
CAV	CAR	HAR	111.2°	111.1°
CAR	CAV	HAV	113.1°	110.9°
CAR	OAG	HOAG	109.5°	114.0°
OAG	CAR	HAR	113.1°	111.0°
O4	C4	C3	108.8°	109.5°
O4	C4	C5	111.5°	109.6°
O4	C4	H4	109.3°	109.5°
C4	O4	HO4	109.5°	114.0°
CAV	O1	C1	108.6°	114.0°
O1	CAV	HAV	113.7°	110.7°
O1	C1	C2	106.9°	109.5°
O1	C1	O5	114.4°	109.6°
O1	C1	H1	108.2°	109.5°
C4	C3	O3	106.2°	109.6°
C4	C3	C2	108.0°	109.0°
C3	C4	C5	112.1°	109.2°
C4	C3	H3	110.6°	109.6°
C3	C4	H4	107.6°	109.5°
O3	C3	C2	109.3°	109.5°
O3	C3	H3	111.8°	109.6°
C3	O3	HO3	109.5°	114.0°
C3	C2	O2	113.0°	109.6°
C3	C2	C1	108.9°	109.1°
C3	C2	H2	108.0°	109.5°
C2	C3	H3	110.8°	109.5°
C6	C5	C4	110.8°	109.5°
C6	C5	O5	113.3°	109.5°
C5	C6	O6	108.5°	109.5°
C6	C5	H5	108.5°	109.5°
C5	C6	H6A	109.7°	109.5°
C5	C6	H6	109.7°	109.5°
C4	C5	O5	106.1°	109.4°
C5	C4	H4	107.4°	109.5°
C4	C5	H5	108.4°	109.4°
C5	O5	C1	113.0°	114.1°
O5	C5	H5	109.7°	109.5°
O6	C6	H6A	109.7°	109.5°
O6	C6	H6	109.7°	109.5°
C6	O6	HO6	109.5°	114.1°
O2	C2	C1	109.9°	109.5°
O2	C2	H2	109.1°	109.6°
C2	O2	HO2	109.5°	113.9°
C2	C1	O5	111.8°	109.4°
C2	C1	H1	107.0°	109.4°
C1	C2	H2	107.8°	109.6°
O5	C1	H1	108.2°	109.4°
H6A	C6	H6	109.5°	109.5°
HAJ	CAJ	HAJA	109.5°	109.5°
HAK	CAK	HAKA	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
OAB	CAJ	CAT	HAJ	120.2°	120.0°
OAB	CAJ	CAT	HAJA	120.3°	120.0°
OAB	CAJ	CAT	OAN	81.0°	66.5°
OAB	CAJ	CAT	CAR	32.5°	177.8°
OAB	CAJ	HAJ	HAJA	119.2°	120.1°
OAB	CAJ	CAT	HAT	160.8°	55.6°
CAJ	CAT	OAN	CAR	123.5°	118.9°
CAJ	CAT	OAN	HAT	116.9°	122.1°
CAJ	CAT	OAN	CAW	128.4°	143.3°
CAJ	CAT	CAR	HAT	128.3°	122.2°
CAJ	CAT	CAR	CAV	141.1°	155.3°
CAJ	CAT	CAR	OAG	104.7°	86.7°
CAT	CAJ	OAB	HOAB	180.0°	180.0°
CAT	CAJ	HAJ	HAJA	119.2°	119.9°
CAJ	CAT	CAR	HAR	21.7°	37.4°
OAH	CAW	OAN	CAT	95.2°	121.2°
OAH	CAW	OAN	CAK	120.7°	120.9°
OAH	CAW	OAN	CAV	117.2°	119.5°
OAH	CAW	CAK	OAC	58.4°	59.3°
OAH	CAW	CAK	CAV	121.1°	120.9°
OAH	CAW	CAV	CAR	80.8°	98.1°
OAH	CAW	CAV	O1	31.7°	20.0°
OAH	CAW	CAK	HAK	178.2°	179.3°
OAH	CAW	CAK	HAKA	61.5°	60.6°
OAH	CAW	CAV	HAV	159.6°	143.5°
OAN	CAT	CAR	HAT	120.8°	118.9°
CAT	OAN	CAW	CAK	144.2°	117.9°
CAT	OAN	CAW	CAV	22.0°	1.7°
OAN	CAT	CAR	CAV	30.1°	36.4°
OAN	CAT	CAR	OAG	144.3°	154.3°
OAN	CAT	CAJ	HAJ	158.8°	53.5°
OAN	CAT	CAJ	HAJA	39.3°	173.5°
OAN	CAT	CAR	HAR	89.3°	81.5°
CAW	OAN	CAT	CAR	4.9°	24.4°
OAN	CAW	CAK	OAC	63.6°	61.6°
OAN	CAW	CAK	CAV	116.9°	118.2°
OAN	CAW	CAV	CAR	39.3°	21.4°
OAN	CAW	CAV	O1	151.7°	139.5°
OAN	CAW	OAH	HOAH	180.0°	61.4°
OAN	CAW	CAK	HAK	56.2°	58.4°
OAN	CAW	CAK	HAKA	176.5°	178.4°
CAW	OAN	CAT	HAT	114.7°	94.5°
OAN	CAW	CAV	HAV	80.4°	96.9°
CAT	CAR	CAV	CAW	41.5°	34.1°
CAT	CAR	CAV	OAG	117.1°	117.9°
CAT	CAR	CAV	HAR	119.0°	118.0°
CAT	CAR	OAG	HAR	125.0°	124.3°
CAT	CAR	CAV	O1	155.4°	152.4°
CAT	CAR	OAG	HOAG	180.0°	68.4°
CAR	CAT	CAJ	HAJ	87.7°	62.1°
CAR	CAT	CAJ	HAJA	152.8°	57.9°
CAT	CAR	CAV	HAV	78.1°	84.3°
OAC	CAK	CAW	HAK	119.9°	120.0°
OAC	CAK	CAW	HAKA	119.9°	120.0°
OAC	CAK	CAW	CAV	179.4°	179.8°
OAC	CAK	HAK	HAKA	120.5°	120.1°
CAK	CAW	CAV	CAR	157.0°	140.9°
CAK	CAW	CAV	O1	90.6°	100.9°
CAW	CAK	OAC	HOAC	180.0°	180.0°
CAK	CAW	OAH	HOAH	60.9°	59.5°
CAW	CAK	HAK	HAKA	120.4°	120.0°
CAK	CAW	CAV	HAV	37.3°	22.6°
CAW	CAV	CAR	O1	113.9°	118.2°
CAW	CAV	CAR	HAV	119.6°	118.4°
CAW	CAV	CAR	OAG	158.6°	152.0°
CAW	CAV	O1	HAV	127.5°	123.7°
CAW	CAV	O1	C1	111.6°	155.7°
CAV	CAW	OAH	HOAH	63.9°	179.5°
CAV	CAW	CAK	HAK	60.7°	59.8°
CAV	CAW	CAK	HAKA	59.6°	60.3°
CAW	CAV	CAR	HAR	77.6°	83.8°
CAV	CAR	OAG	HAR	122.6°	124.2°
CAR	CAV	O1	HAV	126.2°	123.4°
CAR	CAV	O1	C1	142.1°	91.5°
CAV	CAR	OAG	HOAG	67.6°	180.0°
CAV	CAR	CAT	HAT	90.7°	82.4°
OAG	CAR	CAV	O1	87.5°	89.8°
OAG	CAR	CAT	HAT	23.6°	35.5°
OAG	CAR	CAV	HAV	39.0°	33.6°
O4	C4	C3	C5	123.9°	120.0°
O4	C4	C3	H4	118.3°	120.1°
O4	C4	C3	O3	60.3°	63.2°
O4	C4	C3	C2	177.5°	177.0°
O4	C4	C5	C6	53.9°	62.5°
O4	C4	C5	H4	119.7°	120.2°
O4	C4	C5	O5	177.3°	177.6°
O4	C4	C3	H3	61.2°	57.1°
O4	C4	C5	H5	65.0°	57.6°
CAV	O1	C1	C2	144.1°	170.0°
CAV	O1	C1	O5	91.5°	70.0°
CAV	O1	C1	H1	29.2°	50.0°
O1	CAV	CAR	HAR	36.4°	34.4°
O1	C1	C2	C3	69.7°	62.4°
O1	C1	O5	C5	59.9°	58.8°
O1	C1	C2	O2	54.6°	57.5°
O1	C1	C2	O5	125.9°	120.1°
O1	C1	C2	H1	115.7°	120.0°
O1	C1	O5	H1	120.7°	120.1°
O1	C1	C2	H2	173.5°	177.7°
C1	O1	CAV	HAV	15.9°	32.0°
C4	C3	O3	C2	116.2°	119.6°
C4	C3	O3	H3	120.7°	120.2°
C4	C3	C2	H3	121.3°	119.9°
C3	C4	C5	C6	176.3°	177.6°
C3	C4	C5	H4	118.0°	119.9°
C3	C4	C5	O5	60.4°	57.6°
C4	C3	C2	O2	176.4°	176.9°
C4	C3	C2	C1	54.0°	57.0°
C4	C3	C2	H2	62.8°	62.9°
C4	C3	O3	HO3	180.0°	180.0°
C3	C4	O4	HO4	180.0°	60.0°
C3	C4	C5	H5	57.3°	62.4°
O3	C3	C2	H3	123.6°	120.2°
O3	C3	C4	C5	175.8°	176.9°
O3	C3	C2	O2	68.5°	63.3°
O3	C3	C2	C1	169.1°	176.9°
O3	C3	C2	H2	52.3°	57.0°
O3	C3	C4	H4	57.9°	57.0°
C2	C3	C4	C5	58.6°	57.0°
C3	C2	O2	C1	121.8°	119.6°
C3	C2	O2	H2	120.2°	120.2°
C3	C2	C1	H2	116.9°	119.9°
C3	C2	C1	O5	56.3°	57.7°
C3	C2	C1	H1	174.6°	177.6°
C3	C2	O2	HO2	180.0°	179.7°
C2	C3	O3	HO3	63.7°	60.5°
C2	C3	C4	H4	59.2°	62.9°
C6	C5	C4	O5	123.3°	120.0°
C6	C5	C4	H5	118.9°	120.1°
C6	C5	O5	H5	121.4°	120.1°
C5	C6	O6	H6A	119.9°	120.0°
C5	C6	O6	H6	119.9°	120.0°
C6	C5	O5	C1	177.1°	178.8°
C6	C5	C4	H4	65.8°	57.7°
C5	C6	H6A	H6	120.5°	120.0°
C5	C6	O6	HO6	180.0°	180.0°
C4	C5	O5	H5	116.8°	119.9°
C4	C5	C6	O6	74.2°	175.0°
C4	C5	O5	C1	61.1°	61.2°
C5	C4	C3	H3	62.7°	62.9°
C5	C4	O4	HO4	55.8°	179.7°
C4	C5	C6	H6A	165.9°	55.0°
C4	C5	C6	H6	45.6°	65.0°
O5	C5	C6	O6	44.8°	65.1°
C5	O5	C1	C2	61.8°	61.2°
C5	O5	C1	H1	179.4°	178.9°
O5	C5	C4	H4	57.6°	62.3°
O5	C5	C6	H6A	75.0°	174.9°
O5	C5	C6	H6	164.7°	54.9°
O6	C6	C5	H5	166.9°	55.0°
O6	C6	H6A	H6	120.4°	120.0°
O2	C2	C1	H2	118.8°	120.2°
O2	C2	C1	O5	179.4°	177.6°
O2	C2	C1	H1	61.1°	62.5°
O2	C2	C3	H3	55.1°	57.0°
C2	C1	O5	H1	117.6°	119.9°
C1	C2	O2	HO2	58.2°	60.1°
C1	C2	C3	H3	67.3°	62.9°
O5	C1	C2	H2	60.6°	62.2°
C1	O5	C5	H5	55.7°	58.7°
H1	C1	C2	H2	57.7°	57.7°
H2	C2	O2	HO2	59.8°	60.1°
H2	C2	C3	H3	175.9°	177.2°
H3	C3	O3	HO3	59.3°	59.7°
H3	C3	C4	H4	179.4°	177.2°
H4	C4	O4	HO4	62.8°	60.1°
H4	C4	C5	H5	175.3°	177.8°
H5	C5	C6	H6A	47.1°	65.0°
H5	C5	C6	H6	73.2°	175.0°
H6A	C6	O6	HO6	60.2°	60.0°
H6	C6	O6	HO6	60.1°	59.9°
HOAB	OAB	CAJ	HAJ	59.7°	60.1°
HOAB	OAB	CAJ	HAJA	59.8°	60.0°
HOAC	OAC	CAK	HAK	60.1°	60.1°
HOAC	OAC	CAK	HAKA	60.2°	60.0°
HOAG	OAG	CAR	HAR	55.0°	55.8°
HAJ	CAJ	CAT	HAT	40.6°	175.6°
HAJA	CAJ	CAT	HAT	78.9°	64.4°
HAR	CAR	CAT	HAT	150.0°	159.6°
HAR	CAR	CAV	HAV	162.9°	157.7°

Definition date:	2011-11-01
Last modified:	2020-07-17
Release status:	OBS
Processing site:	RCSB
Sub-components:	FRU GLC
Derived from:	3UEQ