GST

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
PA	O1A	sing	1.61Å	1.49Å
PA	O2A	doub	1.48Å	1.49Å
PA	O3A	sing	1.61Å	1.49Å
PA	O1B	sing	1.61Å	1.61Å
O1A	H1A	sing	0.97Å	0.95Å
O3A	H3A	sing	0.97Å	0.95Å
O1B	PB	sing	1.61Å	1.59Å
PB	O2B	doub	1.48Å	1.50Å
PB	O3B	sing	1.61Å	1.50Å
PB	S1	sing	2.12Å	1.62Å
O3B	H3B	sing	0.97Å	0.95Å
S1	C1	sing	1.81Å	1.42Å
C1	C2	sing	1.51Å	1.51Å
C1	H11	sing	1.09Å	1.11Å
C1	H12	sing	1.09Å	1.11Å
C2	C3	doub	1.31Å	1.35Å
C2	H2	sing	1.08Å	1.10Å
C3	C10	sing	1.51Å	1.51Å
C3	C4	sing	1.51Å	1.52Å
C10	H101	sing	1.09Å	1.11Å
C10	H102	sing	1.09Å	1.12Å
C10	H103	sing	1.09Å	1.12Å
C4	C5	sing	1.53Å	1.54Å
C4	H41	sing	1.09Å	1.12Å
C4	H42	sing	1.09Å	1.12Å
C5	C6	sing	1.51Å	1.51Å
C5	H51	sing	1.09Å	1.11Å
C5	H52	sing	1.09Å	1.11Å
C6	C7	doub	1.31Å	1.35Å
C6	H6	sing	1.08Å	1.10Å
C7	C9	sing	1.51Å	1.51Å
C7	C8	sing	1.51Å	1.51Å
C9	H91	sing	1.09Å	1.11Å
C9	H92	sing	1.09Å	1.12Å
C9	H93	sing	1.09Å	1.12Å
C8	H81	sing	1.09Å	1.11Å
C8	H82	sing	1.09Å	1.12Å
C8	H83	sing	1.09Å	1.12Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1A	PA	O2A	112.2°	109.4°
O1A	PA	O3A	111.1°	109.5°
O1A	PA	O1B	106.1°	109.5°
PA	O1A	H1A	112.2°	106.8°
O2A	PA	O3A	111.3°	109.5°
O2A	PA	O1B	108.3°	109.5°
O3A	PA	O1B	107.5°	109.5°
PA	O3A	H3A	111.1°	106.8°
PA	O1B	PB	129.5°	106.8°
O1B	PB	O2B	111.6°	109.5°
O1B	PB	O3B	112.5°	109.5°
O1B	PB	S1	111.9°	109.5°
O2B	PB	O3B	107.4°	109.5°
O2B	PB	S1	105.7°	109.4°
O3B	PB	S1	107.4°	109.4°
PB	O3B	H3B	112.6°	106.8°
PB	S1	C1	122.2°	100.0°
S1	C1	C2	111.2°	109.5°
S1	C1	H11	111.5°	109.5°
S1	C1	H12	111.6°	109.5°
C2	C1	H11	111.6°	109.4°
C2	C1	H12	111.6°	109.4°
C1	C2	C3	125.5°	120.0°
C1	C2	H2	123.7°	120.0°
H11	C1	H12	98.8°	109.5°
C3	C2	H2	110.8°	120.0°
C2	C3	C10	123.0°	120.0°
C2	C3	C4	121.1°	120.0°
C10	C3	C4	115.9°	120.0°
C3	C10	H101	123.0°	109.4°
C3	C10	H102	107.4°	109.5°
C3	C10	H103	107.4°	109.5°
C3	C4	C5	111.2°	109.4°
C3	C4	H41	111.5°	109.4°
C3	C4	H42	111.6°	109.5°
H101	C10	H102	107.4°	109.5°
H101	C10	H103	107.5°	109.4°
H102	C10	H103	102.4°	109.5°
C5	C4	H41	111.6°	109.5°
C5	C4	H42	111.6°	109.5°
C4	C5	C6	112.0°	109.4°
C4	C5	H51	111.2°	109.5°
C4	C5	H52	111.3°	109.5°
H41	C4	H42	98.8°	109.5°
C6	C5	H51	111.3°	109.4°
C6	C5	H52	111.3°	109.4°
C5	C6	C7	127.1°	120.0°
C5	C6	H6	123.0°	120.0°
H51	C5	H52	99.1°	109.5°
C7	C6	H6	109.9°	120.0°
C6	C7	C9	121.0°	120.0°
C6	C7	C8	124.8°	120.0°
C9	C7	C8	114.2°	119.9°
C7	C9	H91	121.0°	109.5°
C7	C9	H92	108.0°	109.5°
C7	C9	H93	108.1°	109.5°
C7	C8	H81	124.9°	109.5°
C7	C8	H82	106.8°	109.4°
C7	C8	H83	106.8°	109.5°
H91	C9	H92	108.2°	109.5°
H91	C9	H93	108.1°	109.4°
H92	C9	H93	101.8°	109.4°
H81	C8	H82	106.8°	109.4°
H81	C8	H83	106.8°	109.5°
H82	C8	H83	102.8°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1A	PA	O2A	O3A	125.3°	120.0°
O1A	PA	O2A	O1B	116.8°	120.0°
O1A	PA	O3A	O1B	115.6°	120.0°
O1A	PA	O3A	H3A	180.0°	60.0°
O1A	PA	O1B	PB	168.5°	80.0°
O2A	PA	O3A	O1B	118.5°	120.0°
O2A	PA	O1A	H1A	179.9°	180.0°
O2A	PA	O3A	H3A	54.1°	60.0°
O2A	PA	O1B	PB	47.8°	40.0°
O3A	PA	O1A	H1A	54.6°	60.0°
O3A	PA	O1B	PB	72.6°	160.0°
O1B	PA	O1A	H1A	62.0°	60.0°
O1B	PA	O3A	H3A	64.4°	180.0°
PA	O1B	PB	O2B	144.8°	60.0°
PA	O1B	PB	O3B	24.0°	60.0°
PA	O1B	PB	S1	97.0°	180.0°
O1B	PB	O2B	O3B	123.8°	120.0°
O1B	PB	O2B	S1	121.9°	120.0°
O1B	PB	O3B	S1	123.6°	120.0°
O1B	PB	O3B	H3B	180.0°	60.0°
O1B	PB	S1	C1	160.8°	180.0°
O2B	PB	O3B	S1	113.2°	120.0°
O2B	PB	O3B	H3B	56.8°	180.0°
O2B	PB	S1	C1	39.1°	60.0°
O3B	PB	S1	C1	75.3°	60.0°
S1	PB	O3B	H3B	56.4°	60.0°
PB	S1	C1	C2	148.5°	75.0°
PB	S1	C1	H11	86.2°	45.0°
PB	S1	C1	H12	23.3°	165.0°
S1	C1	C2	H11	125.2°	120.0°
S1	C1	C2	H12	125.2°	120.1°
S1	C1	H11	H12	117.5°	120.1°
S1	C1	C2	C3	119.4°	113.8°
S1	C1	C2	H2	60.6°	66.2°
C2	C1	H11	H12	117.5°	119.9°
C1	C2	C3	H2	180.0°	180.0°
C1	C2	C3	C10	39.3°	173.4°
C1	C2	C3	C4	142.9°	6.6°
H11	C1	C2	C3	5.8°	126.2°
H11	C1	C2	H2	174.2°	53.8°
H12	C1	C2	C3	115.4°	6.2°
H12	C1	C2	H2	64.7°	173.8°
C2	C3	C10	C4	178.0°	180.0°
C2	C3	C10	H101	180.0°	0.0°
C2	C3	C10	H102	54.8°	120.0°
C2	C3	C10	H103	54.7°	120.0°
C2	C3	C4	C5	176.8°	94.6°
C2	C3	C4	H41	51.5°	25.4°
C2	C3	C4	H42	57.9°	145.4°
H2	C2	C3	C10	140.7°	6.6°
H2	C2	C3	C4	37.2°	173.4°
C3	C10	H101	H102	125.2°	120.0°
C3	C10	H101	H103	125.3°	120.0°
C3	C10	H102	H103	112.9°	120.0°
C10	C3	C4	C5	5.2°	85.4°
C10	C3	C4	H41	130.5°	154.6°
C10	C3	C4	H42	120.1°	34.6°
C4	C3	C10	H101	2.0°	180.0°
C4	C3	C10	H102	123.2°	60.0°
C4	C3	C10	H103	127.3°	60.1°
C3	C4	C5	H41	125.3°	119.9°
C3	C4	C5	H42	125.3°	120.0°
C3	C4	H41	H42	117.4°	120.0°
C3	C4	C5	C6	150.5°	180.0°
C3	C4	C5	H51	25.3°	60.1°
C3	C4	C5	H52	84.2°	60.0°
H101	C10	H102	H103	113.0°	120.0°
C5	C4	H41	H42	117.5°	120.0°
C4	C5	C6	H51	125.2°	120.0°
C4	C5	C6	H52	125.3°	120.1°
C4	C5	H51	H52	117.2°	120.1°
C4	C5	C6	C7	113.2°	124.8°
C4	C5	C6	H6	66.8°	55.3°
H41	C4	C5	C6	84.2°	60.1°
H41	C4	C5	H51	150.6°	180.0°
H41	C4	C5	H52	41.1°	59.9°
H42	C4	C5	C6	25.3°	60.0°
H42	C4	C5	H51	100.0°	60.0°
H42	C4	C5	H52	150.5°	179.9°
C6	C5	H51	H52	117.2°	120.0°
C5	C6	C7	H6	180.0°	179.9°
C5	C6	C7	C9	72.3°	5.9°
C5	C6	C7	C8	108.2°	174.0°
H51	C5	C6	C7	121.6°	115.2°
H51	C5	C6	H6	58.4°	64.7°
H52	C5	C6	C7	12.1°	4.8°
H52	C5	C6	H6	168.0°	175.3°
C6	C7	C9	C8	179.6°	179.9°
C6	C7	C9	H91	180.0°	174.9°
C6	C7	C9	H92	54.7°	65.1°
C6	C7	C9	H93	54.7°	54.9°
C6	C7	C8	H81	180.0°	90.0°
C6	C7	C8	H82	54.7°	30.0°
C6	C7	C8	H83	54.7°	149.9°
H6	C6	C7	C9	107.7°	174.0°
H6	C6	C7	C8	71.8°	6.0°
C7	C9	H91	H92	125.2°	120.1°
C7	C9	H91	H93	125.2°	120.0°
C7	C9	H92	H93	113.7°	120.0°
C9	C7	C8	H81	0.5°	90.1°
C9	C7	C8	H82	125.8°	150.0°
C9	C7	C8	H83	124.8°	30.0°
C8	C7	C9	H91	0.4°	5.2°
C8	C7	C9	H92	124.9°	114.9°
C8	C7	C9	H93	125.7°	125.2°
C7	C8	H81	H82	125.3°	119.9°
C7	C8	H81	H83	125.3°	120.1°
C7	C8	H82	H83	112.2°	120.0°
H91	C9	H92	H93	113.8°	119.9°
H81	C8	H82	H83	112.2°	120.0°

Definition date:	2005-05-11
Last modified:	2021-03-13
Release status:	REL
Processing site:	RCSB
Derived from:	1ZB6