GPP

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	O1	sing	1.43Å	1.42Å
C1	C2	sing	1.51Å	1.51Å
C1	H11	sing	1.09Å	1.11Å
C1	H12	sing	1.09Å	1.12Å
O1	PA	sing	1.61Å	1.63Å
C2	C3	doub	1.31Å	1.34Å
C2	H2	sing	1.08Å	1.10Å
C3	C4	sing	1.51Å	1.52Å
C3	C5	sing	1.51Å	1.54Å
C4	H41	sing	1.09Å	1.11Å
C4	H42	sing	1.09Å	1.11Å
C4	H43	sing	1.09Å	1.12Å
C5	C6	sing	1.53Å	1.53Å
C5	H51	sing	1.09Å	1.12Å
C5	H52	sing	1.09Å	1.12Å
C6	C7	sing	1.51Å	1.51Å
C6	H61	sing	1.09Å	1.11Å
C6	H62	sing	1.09Å	1.11Å
C7	C8	doub	1.31Å	1.33Å
C7	H7	sing	1.08Å	1.10Å
C8	C9	sing	1.51Å	1.53Å
C8	C10	sing	1.51Å	1.54Å
C9	H91	sing	1.09Å	1.11Å
C9	H92	sing	1.09Å	1.11Å
C9	H93	sing	1.09Å	1.11Å
C10	H101	sing	1.09Å	1.11Å
C10	H102	sing	1.09Å	1.12Å
C10	H103	sing	1.09Å	1.11Å
PA	O1A	doub	1.48Å	1.65Å
PA	O2A	sing	1.61Å	1.58Å
PA	O3A	sing	1.61Å	1.56Å
O2A	HOA2	sing	0.97Å	0.95Å
O3A	PB	sing	1.61Å	1.56Å
PB	O1B	doub	1.48Å	1.61Å
PB	O2B	sing	1.61Å	1.59Å
PB	O3B	sing	1.61Å	1.59Å
O2B	HOB2	sing	0.97Å	0.95Å
O3B	HOB3	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	C1	C2	113.5°	109.5°
O1	C1	H11	110.8°	109.5°
O1	C1	H12	110.7°	109.5°
C1	O1	PA	129.9°	106.8°
C2	C1	H11	110.7°	109.5°
C2	C1	H12	110.7°	109.4°
C1	C2	C3	121.4°	120.0°
C1	C2	H2	125.3°	120.0°
H11	C1	H12	99.6°	109.4°
O1	PA	O1A	107.9°	109.4°
O1	PA	O2A	117.9°	109.5°
O1	PA	O3A	106.4°	109.5°
C3	C2	H2	113.4°	120.0°
C2	C3	C4	116.2°	120.0°
C2	C3	C5	120.3°	120.0°
C4	C3	C5	123.4°	120.0°
C3	C4	H41	116.3°	109.5°
C3	C4	H42	109.8°	109.5°
C3	C4	H43	109.8°	109.5°
C3	C5	C6	124.4°	109.5°
C3	C5	H51	106.9°	109.4°
C3	C5	H52	106.9°	109.6°
H41	C4	H42	109.8°	109.4°
H41	C4	H43	109.7°	109.4°
H42	C4	H43	100.5°	109.5°
C6	C5	H51	106.9°	109.4°
C6	C5	H52	107.0°	109.5°
C5	C6	C7	110.6°	109.5°
C5	C6	H61	111.8°	109.4°
C5	C6	H62	111.8°	109.5°
H51	C5	H52	102.7°	109.4°
C7	C6	H61	111.7°	109.5°
C7	C6	H62	111.8°	109.5°
C6	C7	C8	118.0°	120.0°
C6	C7	H7	126.7°	120.0°
H61	C6	H62	98.6°	109.5°
C8	C7	H7	115.2°	120.0°
C7	C8	C9	115.1°	120.0°
C7	C8	C10	115.3°	120.0°
C9	C8	C10	129.5°	120.0°
C8	C9	H91	115.1°	109.5°
C8	C9	H92	110.1°	109.5°
C8	C9	H93	110.1°	109.4°
C8	C10	H101	115.3°	109.5°
C8	C10	H102	110.1°	109.5°
C8	C10	H103	110.0°	109.5°
H91	C9	H92	110.2°	109.5°
H91	C9	H93	110.2°	109.4°
H92	C9	H93	100.1°	109.4°
H101	C10	H102	110.1°	109.4°
H101	C10	H103	110.2°	109.4°
H102	C10	H103	100.1°	109.5°
O1A	PA	O2A	113.7°	109.5°
O1A	PA	O3A	106.5°	109.5°
O2A	PA	O3A	103.4°	109.5°
PA	O2A	HOA2	118.0°	106.8°
PA	O3A	PB	123.3°	106.8°
O3A	PB	O1B	155.3°	109.5°
O3A	PB	O2B	89.7°	109.5°
O3A	PB	O3B	104.6°	109.5°
O1B	PB	O2B	98.4°	109.5°
O1B	PB	O3B	94.6°	109.5°
O2B	PB	O3B	110.0°	109.4°
PB	O2B	HOB2	89.6°	106.8°
PB	O3B	HOB3	104.6°	106.9°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	C1	C2	H11	125.3°	120.1°
O1	C1	C2	H12	125.2°	120.0°
O1	C1	H11	H12	116.6°	120.0°
O1	C1	C2	C3	143.8°	135.4°
O1	C1	C2	H2	36.3°	44.6°
C1	O1	PA	O1A	106.7°	60.0°
C1	O1	PA	O2A	23.9°	60.0°
C1	O1	PA	O3A	139.3°	180.0°
C2	C1	H11	H12	116.5°	119.9°
C2	C1	O1	PA	116.7°	180.0°
C1	C2	C3	H2	179.9°	180.0°
C1	C2	C3	C4	0.5°	5.7°
C1	C2	C3	C5	177.2°	174.4°
H11	C1	O1	PA	118.0°	60.0°
H11	C1	C2	C3	18.4°	104.5°
H11	C1	C2	H2	161.6°	75.5°
H12	C1	O1	PA	8.5°	60.0°
H12	C1	C2	C3	91.0°	15.4°
H12	C1	C2	H2	88.9°	164.6°
O1	PA	O1A	O2A	132.8°	120.0°
O1	PA	O1A	O3A	113.9°	120.0°
O1	PA	O2A	O3A	117.0°	120.0°
O1	PA	O2A	HOA2	179.9°	60.0°
O1	PA	O3A	PB	64.1°	179.9°
C2	C3	C4	C5	176.6°	179.9°
C2	C3	C4	H41	180.0°	54.8°
C2	C3	C4	H42	54.7°	174.8°
C2	C3	C4	H43	54.8°	65.2°
C2	C3	C5	C6	58.6°	90.0°
C2	C3	C5	H51	176.1°	30.0°
C2	C3	C5	H52	66.7°	149.9°
H2	C2	C3	C4	179.4°	174.3°
H2	C2	C3	C5	2.7°	5.6°
C3	C4	H41	H42	125.3°	120.0°
C3	C4	H41	H43	125.2°	120.0°
C3	C4	H42	H43	115.6°	120.0°
C4	C3	C5	C6	125.0°	90.1°
C4	C3	C5	H51	0.3°	150.0°
C4	C3	C5	H52	109.7°	30.0°
C5	C3	C4	H41	3.4°	125.1°
C5	C3	C4	H42	128.7°	5.1°
C5	C3	C4	H43	121.8°	114.9°
C3	C5	C6	H51	125.3°	120.0°
C3	C5	C6	H52	125.3°	120.1°
C3	C5	H51	H52	112.3°	120.1°
C3	C5	C6	C7	177.2°	180.0°
C3	C5	C6	H61	52.0°	60.0°
C3	C5	C6	H62	57.5°	59.9°
H41	C4	H42	H43	115.5°	119.9°
C6	C5	H51	H52	112.4°	120.0°
C5	C6	C7	H61	125.2°	119.9°
C5	C6	C7	H62	125.3°	120.0°
C5	C6	H61	H62	117.7°	119.9°
C5	C6	C7	C8	171.4°	125.8°
C5	C6	C7	H7	8.7°	54.4°
H51	C5	C6	C7	57.5°	60.0°
H51	C5	C6	H61	177.3°	180.0°
H51	C5	C6	H62	67.8°	60.0°
H52	C5	C6	C7	51.9°	59.9°
H52	C5	C6	H61	73.3°	60.1°
H52	C5	C6	H62	177.2°	180.0°
C7	C6	H61	H62	117.7°	120.1°
C6	C7	C8	H7	180.0°	179.9°
C6	C7	C8	C9	0.3°	174.4°
C6	C7	C8	C10	180.0°	5.6°
H61	C6	C7	C8	63.4°	114.3°
H61	C6	C7	H7	116.6°	65.6°
H62	C6	C7	C8	46.1°	5.8°
H62	C6	C7	H7	133.9°	174.4°
C7	C8	C9	C10	179.7°	180.0°
C7	C8	C9	H91	180.0°	179.9°
C7	C8	C9	H92	54.7°	60.0°
C7	C8	C9	H93	54.7°	60.0°
C7	C8	C10	H101	179.9°	54.9°
C7	C8	C10	H102	54.7°	174.9°
C7	C8	C10	H103	54.7°	65.0°
H7	C7	C8	C9	179.7°	5.7°
H7	C7	C8	C10	0.0°	174.3°
C8	C9	H91	H92	125.3°	120.1°
C8	C9	H91	H93	125.2°	119.9°
C8	C9	H92	H93	115.9°	119.9°
C9	C8	C10	H101	0.3°	125.1°
C9	C8	C10	H102	125.0°	5.1°
C9	C8	C10	H103	125.6°	115.0°
C10	C8	C9	H91	0.3°	0.1°
C10	C8	C9	H92	125.6°	120.0°
C10	C8	C9	H93	125.0°	120.0°
C8	C10	H101	H102	125.3°	120.0°
C8	C10	H101	H103	125.3°	120.0°
C8	C10	H102	H103	115.8°	120.1°
H91	C9	H92	H93	116.0°	120.0°
H101	C10	H102	H103	115.9°	119.9°
O1A	PA	O2A	O3A	115.1°	120.0°
O1A	PA	O2A	HOA2	52.1°	179.9°
O1A	PA	O3A	PB	179.1°	60.0°
O2A	PA	O3A	PB	60.8°	60.0°
O3A	PA	O2A	HOA2	63.0°	60.0°
PA	O3A	PB	O1B	18.5°	60.0°
PA	O3A	PB	O2B	128.2°	180.0°
PA	O3A	PB	O3B	121.2°	60.0°
O3A	PB	O1B	O2B	107.9°	120.0°
O3A	PB	O1B	O3B	141.1°	120.1°
O3A	PB	O2B	O3B	105.4°	120.1°
O3A	PB	O2B	HOB2	180.0°	179.9°
O3A	PB	O3B	HOB3	179.9°	59.9°
O1B	PB	O2B	O3B	98.0°	120.0°
O1B	PB	O2B	HOB2	23.4°	59.9°
O1B	PB	O3B	HOB3	15.7°	180.0°
O2B	PB	O3B	HOB3	85.0°	60.1°
O3B	PB	O2B	HOB2	74.6°	60.0°

Definition date:	1999-07-08
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	1UBW