2M0

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O43	S42	doub	1.42Å	1.53Å
C41	C26	sing	1.53Å	1.55Å
C41	C25	sing	1.53Å	1.55Å
C26	S42	sing	1.81Å	1.84Å
S42	C45	sing	1.81Å	1.78Å
S42	O44	doub	1.42Å	1.52Å
C27	C25	sing	1.53Å	1.54Å
C27	C28	sing	1.53Å	1.54Å
C30	C28	sing	1.53Å	1.54Å
C25	N24	sing	1.47Å	1.48Å
C28	C29	sing	1.53Å	1.53Å
C26	H14	sing	1.09Å	1.10Å
C26	H15	sing	1.09Å	1.10Å
C28	H16	sing	1.09Å	1.10Å
C41	H17	sing	1.09Å	1.10Å
C41	H18	sing	1.09Å	1.10Å
C45	H19	sing	1.09Å	1.10Å
C45	H20	sing	1.09Å	1.10Å
C45	H21	sing	1.09Å	1.10Å
C25	H22	sing	1.09Å	1.10Å
C27	H23	sing	1.09Å	1.10Å
C27	H24	sing	1.09Å	1.10Å
C30	H25	sing	1.09Å	1.10Å
C30	H26	sing	1.09Å	1.10Å
C30	H27	sing	1.09Å	1.10Å
C29	H28	sing	1.09Å	1.10Å
C29	H29	sing	1.09Å	1.10Å
C29	H30	sing	1.09Å	1.10Å
N24	H31	sing	1.01Å	1.00Å
N24	H2	sing	1.01Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O43	S42	C26	110.9°	108.6°
O43	S42	C45	108.8°	108.6°
O43	S42	O44	109.7°	119.2°
C26	C41	C25	110.6°	109.5°
C41	C26	S42	113.2°	109.5°
C41	C26	H14	108.5°	109.5°
C41	C26	H15	108.5°	109.5°
C26	C41	H17	109.2°	109.5°
C26	C41	H18	109.2°	109.5°
C41	C25	C27	110.4°	109.5°
C41	C25	N24	108.5°	109.5°
C25	C41	H17	109.2°	109.5°
C25	C41	H18	109.2°	109.5°
C41	C25	H22	108.5°	109.5°
C26	S42	C45	109.1°	101.9°
C26	S42	O44	109.3°	108.6°
S42	C26	H14	108.5°	109.5°
S42	C26	H15	108.5°	109.5°
C45	S42	O44	109.0°	108.6°
S42	C45	H19	109.5°	109.5°
S42	C45	H20	109.5°	109.5°
S42	C45	H21	109.4°	109.5°
C25	C27	C28	112.8°	109.5°
C27	C25	N24	111.5°	109.5°
C27	C25	H22	108.5°	109.5°
C25	C27	H23	108.6°	109.5°
C25	C27	H24	108.6°	109.5°
C27	C28	C30	108.9°	109.5°
C27	C28	C29	111.6°	109.5°
C27	C28	H16	108.9°	109.5°
C28	C27	H23	108.6°	109.4°
C28	C27	H24	108.6°	109.5°
C30	C28	C29	109.4°	109.5°
C30	C28	H16	109.0°	109.5°
C28	C30	H25	109.5°	109.5°
C28	C30	H26	109.5°	109.5°
C28	C30	H27	109.5°	109.5°
N24	C25	H22	109.4°	109.5°
C25	N24	H31	109.5°	111.0°
C25	N24	H2	109.5°	111.0°
C29	C28	H16	109.0°	109.4°
C28	C29	H28	109.5°	109.4°
C28	C29	H29	109.5°	109.4°
C28	C29	H30	109.5°	109.5°
H14	C26	H15	109.5°	109.4°
H17	C41	H18	109.4°	109.4°
H19	C45	H20	109.5°	109.4°
H19	C45	H21	109.5°	109.4°
H20	C45	H21	109.5°	109.5°
H23	C27	H24	109.5°	109.5°
H25	C30	H26	109.5°	109.5°
H25	C30	H27	109.5°	109.4°
H26	C30	H27	109.4°	109.5°
H28	C29	H29	109.5°	109.5°
H28	C29	H30	109.5°	109.5°
H29	C29	H30	109.5°	109.5°
H31	N24	H2	109.5°	111.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O43	S42	C26	C41	77.0°	65.5°
O43	S42	C26	C45	119.8°	114.5°
O43	S42	C26	O44	121.1°	131.0°
O43	S42	C45	O44	119.6°	131.0°
O43	S42	C26	H14	43.5°	174.5°
O43	S42	C26	H15	162.4°	54.5°
O43	S42	C45	H19	180.0°	54.5°
O43	S42	C45	H20	60.0°	65.5°
O43	S42	C45	H21	60.0°	174.5°
C26	C41	C25	H17	120.2°	120.0°
C26	C41	C25	H18	120.2°	120.0°
C41	C26	S42	H14	120.6°	120.0°
C41	C26	S42	H15	120.6°	120.0°
C41	C26	S42	C45	163.1°	180.0°
C41	C26	S42	O44	44.1°	65.5°
C26	C41	C25	C27	71.0°	175.0°
C26	C41	C25	N24	51.5°	65.0°
C41	C26	H14	H15	118.3°	120.0°
C26	C41	H17	H18	119.5°	120.0°
C26	C41	C25	H22	170.2°	55.0°
C25	C41	C26	S42	134.6°	180.0°
C41	C25	C27	N24	120.7°	120.0°
C41	C25	C27	H22	118.7°	120.0°
C41	C25	C27	C28	171.4°	175.0°
C41	C25	N24	H22	118.2°	120.0°
C25	C41	C26	H14	104.9°	60.0°
C25	C41	C26	H15	14.0°	60.0°
C25	C41	H17	H18	119.5°	120.0°
C41	C25	C27	H23	50.9°	55.0°
C41	C25	C27	H24	68.2°	65.1°
C41	C25	N24	H31	180.0°	60.0°
C41	C25	N24	H2	60.0°	176.0°
C26	S42	C45	O44	119.2°	114.5°
S42	C26	H14	H15	118.3°	120.0°
S42	C26	C41	H17	105.2°	60.0°
S42	C26	C41	H18	14.4°	60.0°
C26	S42	C45	H19	58.8°	60.0°
C26	S42	C45	H20	178.8°	180.0°
C26	S42	C45	H21	61.2°	60.0°
C45	S42	C26	H14	76.3°	60.0°
C45	S42	C26	H15	42.6°	60.0°
S42	C45	H19	H20	120.0°	120.0°
S42	C45	H19	H21	120.0°	120.0°
S42	C45	H20	H21	120.0°	120.0°
O44	S42	C26	H14	164.6°	54.5°
O44	S42	C26	H15	76.5°	174.5°
O44	S42	C45	H19	60.4°	174.5°
O44	S42	C45	H20	59.6°	65.5°
O44	S42	C45	H21	179.6°	54.5°
C25	C27	C28	H23	120.5°	120.0°
C25	C27	C28	H24	120.5°	120.0°
C25	C27	C28	C30	178.3°	175.0°
C27	C25	N24	H22	120.0°	120.0°
C25	C27	C28	C29	60.8°	65.0°
C25	C27	C28	H16	59.6°	55.0°
C27	C25	C41	H17	49.2°	65.0°
C27	C25	C41	H18	168.9°	55.0°
C25	C27	H23	H24	118.5°	120.0°
C27	C25	N24	H31	58.2°	60.0°
C27	C25	N24	H2	178.2°	64.0°
C27	C28	C30	C29	122.2°	120.0°
C27	C28	C30	H16	118.7°	120.0°
C28	C27	C25	N24	50.7°	65.0°
C27	C28	C29	H16	120.3°	120.0°
C28	C27	C25	H22	69.9°	55.0°
C28	C27	H23	H24	118.5°	120.0°
C27	C28	C30	H25	180.0°	180.0°
C27	C28	C30	H26	60.0°	60.0°
C27	C28	C30	H27	60.0°	60.0°
C27	C28	C29	H28	180.0°	60.0°
C27	C28	C29	H29	60.0°	179.9°
C27	C28	C29	H30	60.0°	60.0°
C30	C28	C29	H16	119.1°	120.0°
C30	C28	C27	H23	57.9°	65.0°
C30	C28	C27	H24	61.2°	55.0°
C28	C30	H25	H26	120.0°	120.0°
C28	C30	H25	H27	120.0°	120.0°
C28	C30	H26	H27	120.0°	120.1°
C30	C28	C29	H28	59.4°	180.0°
C30	C28	C29	H29	60.6°	60.1°
C30	C28	C29	H30	179.4°	60.0°
N24	C25	C41	H17	171.7°	55.0°
N24	C25	C41	H18	68.7°	175.0°
N24	C25	C27	H23	69.8°	175.0°
N24	C25	C27	H24	171.2°	55.0°
C25	N24	H31	H2	120.0°	124.0°
C29	C28	C27	H23	178.7°	55.0°
C29	C28	C27	H24	59.7°	175.0°
C29	C28	C30	H25	57.8°	60.0°
C29	C28	C30	H26	177.8°	180.0°
C29	C28	C30	H27	62.2°	60.0°
C28	C29	H28	H29	120.0°	119.9°
C28	C29	H28	H30	120.0°	120.0°
C28	C29	H29	H30	120.0°	120.0°
H14	C26	C41	H17	15.3°	60.0°
H14	C26	C41	H18	134.9°	180.0°
H15	C26	C41	H17	134.2°	180.0°
H15	C26	C41	H18	106.1°	60.0°
H16	C28	C27	H23	60.9°	175.0°
H16	C28	C27	H24	179.9°	65.0°
H16	C28	C30	H25	61.3°	60.0°
H16	C28	C30	H26	58.7°	60.0°
H16	C28	C30	H27	178.7°	180.0°
H16	C28	C29	H28	59.7°	60.0°
H16	C28	C29	H29	179.7°	59.9°
H16	C28	C29	H30	60.3°	180.0°
H17	C41	C25	H22	69.6°	175.0°
H18	C41	C25	H22	50.1°	65.0°
H19	C45	H20	H21	120.0°	119.9°
H22	C25	C27	H23	169.6°	65.0°
H22	C25	C27	H24	50.6°	175.0°
H22	C25	N24	H31	61.9°	180.0°
H22	C25	N24	H2	58.1°	56.0°
H25	C30	H26	H27	120.0°	119.9°
H28	C29	H29	H30	120.0°	120.0°

Release date:	2014-02-12
Definition date:	2013-12-02
Last modified:	2014-02-07
Release status:	REL
Processing site:	RCSB
Derived from:	4NO6