BP2

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C2	C3	sing	1.56Å	1.55Å
C2	C7	sing	1.56Å	1.57Å
C2	C8	sing	1.56Å	1.55Å
C2	C11	sing	1.52Å	1.51Å
C3	C4	sing	1.54Å	1.53Å
C3	O3	sing	1.42Å	1.45Å
C3	HC3	sing	1.10Å	1.11Å
C4	C5	sing	1.55Å	1.55Å
C4	HC41	sing	1.09Å	1.11Å
C4	HC42	sing	1.10Å	1.11Å
C5	C6	sing	1.55Å	1.56Å
C5	C8	sing	1.55Å	1.54Å
C5	HC5	sing	1.09Å	1.12Å
C6	C7	sing	1.54Å	1.58Å
C6	HC61	sing	1.09Å	1.12Å
C6	HC62	sing	1.10Å	1.11Å
C7	HC71	sing	1.10Å	1.11Å
C7	HC72	sing	1.09Å	1.12Å
C8	C9	sing	1.54Å	1.54Å
C8	C10	sing	1.54Å	1.55Å
C9	HC91	sing	1.09Å	1.12Å
C9	HC92	sing	1.09Å	1.12Å
C9	HC93	sing	1.09Å	1.11Å
C10	H101	sing	1.09Å	1.12Å
C10	H102	sing	1.09Å	1.12Å
C10	H103	sing	1.09Å	1.12Å
C11	H111	sing	1.09Å	1.12Å
C11	H112	sing	1.09Å	1.11Å
C11	H113	sing	1.09Å	1.11Å
P1	O1	doub	1.50Å	1.57Å
P1	O2	sing	1.62Å	1.59Å
P1	O3	sing	1.62Å	1.53Å
P1	O	sing	1.62Å	1.59Å
O	P2	sing	1.62Å	1.59Å
P2	O4	doub	1.51Å	1.60Å
P2	O5	sing	1.51Å	1.57Å
P2	O6	sing	1.65Å	1.50Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C3	C2	C7	104.9°	107.8°
C3	C2	C8	106.4°	102.3°
C3	C2	C11	113.7°	113.3°
C2	C3	C4	103.1°	102.8°
C2	C3	O3	113.2°	113.4°
C2	C3	HC3	112.2°	111.6°
C7	C2	C8	104.7°	102.7°
C7	C2	C11	110.5°	112.6°
C2	C7	C6	100.4°	102.8°
C2	C7	HC71	115.7°	111.2°
C2	C7	HC72	115.7°	113.5°
C8	C2	C11	115.8°	116.9°
C2	C8	C5	88.2°	91.4°
C2	C8	C9	117.3°	115.5°
C2	C8	C10	116.8°	115.6°
C2	C11	H111	113.6°	110.6°
C2	C11	H112	110.7°	110.6°
C2	C11	H113	110.6°	110.6°
C4	C3	O3	112.1°	110.7°
C4	C3	HC3	113.3°	110.4°
C3	C4	C5	100.1°	102.7°
C3	C4	HC41	115.8°	113.4°
C3	C4	HC42	115.8°	109.9°
O3	C3	HC3	103.2°	107.9°
C3	O3	P1	122.0°	120.0°
C5	C4	HC41	115.8°	112.9°
C5	C4	HC42	115.8°	109.9°
C4	C5	C6	105.3°	106.3°
C4	C5	C8	108.6°	103.8°
C4	C5	HC5	111.5°	113.3°
HC41	C4	HC42	94.6°	108.0°
C6	C5	C8	105.3°	103.5°
C6	C5	HC5	114.4°	113.2°
C5	C6	C7	100.7°	102.9°
C5	C6	HC61	115.6°	112.8°
C5	C6	HC62	115.6°	111.1°
C8	C5	HC5	111.4°	115.6°
C5	C8	C9	116.5°	114.1°
C5	C8	C10	115.4°	114.1°
C7	C6	HC61	115.6°	112.0°
C7	C6	HC62	115.6°	110.2°
C6	C7	HC71	115.7°	110.0°
C6	C7	HC72	115.7°	112.0°
HC61	C6	HC62	94.8°	107.9°
HC71	C7	HC72	94.8°	107.3°
C9	C8	C10	103.1°	106.1°
C8	C9	HC91	117.3°	110.6°
C8	C9	HC92	109.4°	110.6°
C8	C9	HC93	109.4°	110.5°
C8	C10	H101	116.8°	110.5°
C8	C10	H102	109.6°	110.6°
C8	C10	H103	109.6°	110.6°
HC91	C9	HC92	109.4°	108.4°
HC91	C9	HC93	109.4°	108.3°
HC92	C9	HC93	100.8°	108.4°
H101	C10	H102	109.5°	108.3°
H101	C10	H103	109.5°	108.4°
H102	C10	H103	100.6°	108.4°
H111	C11	H112	110.7°	108.3°
H111	C11	H113	110.7°	108.3°
H112	C11	H113	99.7°	108.3°
O1	P1	O2	108.1°	114.4°
O1	P1	O3	112.0°	115.1°
O1	P1	O	106.4°	114.5°
O2	P1	O3	109.7°	104.8°
O2	P1	O	107.5°	103.7°
O3	P1	O	112.9°	102.9°
P1	O	P2	130.9°	130.4°
O	P2	O4	105.5°	112.2°
O	P2	O5	108.3°	112.0°
O	P2	O6	109.3°	100.5°
O4	P2	O5	109.3°	125.6°
O4	P2	O6	110.9°	100.8°
O5	P2	O6	113.2°	100.8°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C3	C2	C7	C8	111.9°	107.6°
C3	C2	C7	C11	122.8°	125.8°
C3	C2	C8	C11	127.4°	124.4°
C2	C3	C4	O3	122.1°	121.4°
C2	C3	C4	HC3	121.5°	119.1°
C2	C3	O3	HC3	121.5°	124.1°
C2	C3	C4	C5	0.1°	2.1°
C2	C3	C4	HC41	125.2°	120.0°
C2	C3	C4	HC42	125.4°	119.0°
C3	C2	C8	C5	52.4°	56.1°
C3	C2	C7	C6	73.1°	70.9°
C3	C2	C7	HC71	52.1°	171.4°
C3	C2	C7	HC72	161.6°	50.3°
C3	C2	C8	C9	66.7°	173.7°
C3	C2	C8	C10	170.1°	61.6°
C3	C2	C11	H111	180.0°	161.4°
C3	C2	C11	H112	54.7°	78.6°
C3	C2	C11	H113	54.8°	41.4°
C2	C3	O3	P1	105.0°	174.9°
C7	C2	C8	C11	121.9°	123.8°
C7	C2	C3	C4	75.1°	70.0°
C7	C2	C3	O3	46.3°	49.6°
C7	C2	C3	HC3	162.7°	171.7°
C2	C7	C6	C5	0.5°	0.7°
C7	C2	C8	C5	58.4°	55.6°
C2	C7	C6	HC71	125.3°	118.5°
C2	C7	C6	HC72	125.2°	122.2°
C2	C7	C6	HC61	125.7°	120.7°
C2	C7	C6	HC62	124.8°	119.2°
C2	C7	HC71	HC72	121.5°	124.7°
C7	C2	C8	C9	177.5°	62.0°
C7	C2	C8	C10	59.3°	173.3°
C7	C2	C11	H111	62.5°	75.8°
C7	C2	C11	H112	62.8°	44.1°
C7	C2	C11	H113	172.3°	164.1°
C8	C2	C3	C4	35.5°	37.9°
C8	C2	C3	O3	156.9°	157.5°
C8	C2	C3	HC3	86.7°	80.4°
C2	C8	C5	C4	54.0°	55.3°
C2	C8	C5	C6	58.4°	55.6°
C2	C8	C5	C9	119.8°	118.8°
C2	C8	C5	C10	119.0°	119.0°
C2	C8	C5	HC5	177.1°	180.0°
C8	C2	C7	C6	38.7°	36.7°
C8	C2	C7	HC71	164.0°	81.0°
C8	C2	C7	HC72	86.5°	157.9°
C2	C8	C9	C10	129.9°	129.5°
C2	C8	C9	HC91	180.0°	64.9°
C2	C8	C9	HC92	54.8°	55.1°
C2	C8	C9	HC93	54.8°	175.1°
C2	C8	C10	H101	180.0°	166.2°
C2	C8	C10	H102	54.8°	73.8°
C2	C8	C10	H103	54.8°	46.2°
C8	C2	C11	H111	56.3°	42.8°
C8	C2	C11	H112	178.4°	162.7°
C8	C2	C11	H113	68.9°	77.3°
C11	C2	C3	C4	164.2°	164.7°
C11	C2	C3	O3	74.4°	75.8°
C11	C2	C3	HC3	41.9°	46.3°
C11	C2	C8	C5	179.7°	179.4°
C11	C2	C7	C6	164.1°	163.3°
C11	C2	C7	HC71	70.7°	45.6°
C11	C2	C7	HC72	38.8°	75.5°
C11	C2	C8	C9	60.6°	61.8°
C11	C2	C8	C10	62.6°	62.9°
C2	C11	H111	H112	125.3°	121.3°
C2	C11	H111	H113	125.2°	121.4°
C2	C11	H112	H113	116.5°	121.4°
C4	C3	O3	HC3	122.3°	120.9°
C3	C4	C5	HC41	125.3°	122.5°
C3	C4	C5	HC42	125.3°	116.9°
C3	C4	HC41	HC42	121.7°	122.0°
C3	C4	C5	C6	76.0°	74.1°
C3	C4	C5	C8	36.4°	34.7°
C3	C4	C5	HC5	159.4°	160.9°
C4	C3	O3	P1	138.9°	60.0°
O3	C3	C4	C5	122.0°	123.6°
O3	C3	C4	HC41	112.7°	1.4°
O3	C3	C4	HC42	3.2°	119.6°
C3	O3	P1	O1	98.5°	60.0°
C3	O3	P1	O2	141.5°	173.4°
C3	O3	P1	O	21.6°	65.3°
HC3	C3	C4	C5	121.6°	117.0°
HC3	C3	C4	HC41	3.7°	120.9°
HC3	C3	C4	HC42	113.2°	0.1°
HC3	C3	O3	P1	16.5°	60.9°
C5	C4	HC41	HC42	121.6°	121.7°
C4	C5	C6	C8	114.7°	109.1°
C4	C5	C6	HC5	122.7°	125.0°
C4	C5	C8	HC5	123.1°	124.7°
C4	C5	C6	C7	76.5°	73.2°
C4	C5	C6	HC61	158.3°	47.6°
C4	C5	C6	HC62	48.9°	168.8°
C4	C5	C8	C9	65.8°	174.2°
C4	C5	C8	C10	173.0°	63.6°
HC41	C4	C5	C6	158.7°	48.3°
HC41	C4	C5	C8	88.9°	157.2°
HC41	C4	C5	HC5	34.1°	76.6°
HC42	C4	C5	C6	49.3°	169.0°
HC42	C4	C5	C8	161.7°	82.2°
HC42	C4	C5	HC5	75.3°	44.0°
C6	C5	C8	HC5	124.5°	124.4°
C5	C6	C7	HC61	125.3°	121.4°
C5	C6	C7	HC62	125.3°	118.5°
C5	C6	HC61	HC62	121.4°	123.0°
C5	C6	C7	HC71	125.7°	117.8°
C5	C6	C7	HC72	124.8°	122.9°
C6	C5	C8	C9	178.1°	63.3°
C6	C5	C8	C10	60.6°	174.5°
C8	C5	C6	C7	38.2°	35.8°
C8	C5	C6	HC61	87.1°	156.7°
C8	C5	C6	HC62	163.5°	82.1°
C5	C8	C9	C10	127.5°	126.5°
C5	C8	C9	HC91	77.4°	39.1°
C5	C8	C9	HC92	157.3°	159.1°
C5	C8	C9	HC93	47.8°	80.9°
C5	C8	C10	H101	78.4°	62.1°
C5	C8	C10	H102	46.8°	177.9°
C5	C8	C10	H103	156.3°	57.9°
HC5	C5	C6	C7	160.8°	161.8°
HC5	C5	C6	HC61	35.6°	77.4°
HC5	C5	C6	HC62	73.9°	43.8°
HC5	C5	C8	C9	57.3°	61.1°
HC5	C5	C8	C10	63.9°	61.1°
C7	C6	HC61	HC62	121.4°	121.5°
C6	C7	HC71	HC72	121.5°	122.1°
HC61	C6	C7	HC71	109.0°	120.8°
HC61	C6	C7	HC72	0.5°	1.5°
HC62	C6	C7	HC71	0.5°	0.7°
HC62	C6	C7	HC72	110.0°	118.6°
C8	C9	HC91	HC92	125.3°	121.3°
C8	C9	HC91	HC93	125.3°	121.3°
C8	C9	HC92	HC93	115.2°	121.3°
C9	C8	C10	H101	49.8°	64.3°
C9	C8	C10	H102	175.0°	55.6°
C9	C8	C10	H103	75.4°	175.7°
C10	C8	C9	HC91	50.1°	165.6°
C10	C8	C9	HC92	75.2°	74.4°
C10	C8	C9	HC93	175.3°	45.6°
C8	C10	H101	H102	125.3°	121.3°
C8	C10	H101	H103	125.3°	121.3°
C8	C10	H102	H103	115.4°	121.4°
HC91	C9	HC92	HC93	115.1°	117.4°
H101	C10	H102	H103	115.3°	117.4°
H111	C11	H112	H113	116.5°	117.3°
O1	P1	O2	O3	122.3°	127.0°
O1	P1	O2	O	114.5°	125.4°
O1	P1	O3	O	120.1°	125.3°
O1	P1	O	P2	58.2°	60.1°
O2	P1	O3	O	119.9°	108.2°
O2	P1	O	P2	57.4°	65.3°
O3	P1	O	P2	178.6°	174.3°
P1	O	P2	O4	46.8°	73.7°
P1	O	P2	O5	70.1°	73.8°
P1	O	P2	O6	166.2°	180.0°
O	P2	O4	O5	116.2°	142.2°
O	P2	O4	O6	118.3°	106.1°
O	P2	O5	O6	121.4°	106.0°
O4	P2	O5	O6	124.2°	111.7°

Definition date:	2002-10-25
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	1N24