6ZW

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C16	C10	sing	1.51Å	1.51Å
C9	C8	sing	1.41Å	1.38Å
C9	C10	doub	1.36Å	1.38Å
O17	C8	doub	1.22Å	1.25Å
C8	O7	sing	1.34Å	1.36Å
C10	C3	sing	1.46Å	1.49Å
O7	C2	sing	1.35Å	1.35Å
C13	C12	sing	1.53Å	1.52Å
C3	C2	doub	1.41Å	1.45Å	Aromatic
C3	C4	sing	1.40Å	1.39Å	Aromatic
C2	C1	sing	1.39Å	1.40Å	Aromatic
C4	C5	doub	1.36Å	1.41Å	Aromatic
C15	C14	sing	1.53Å	1.52Å
C1	C6	doub	1.39Å	1.40Å	Aromatic
C5	C6	sing	1.40Å	1.40Å	Aromatic
C6	N11	sing	1.39Å	1.45Å
N11	C12	sing	1.47Å	1.46Å
N11	C14	sing	1.46Å	1.49Å
C9	H1	sing	1.08Å	1.08Å
C16	H2	sing	1.09Å	1.10Å
C16	H3	sing	1.09Å	1.10Å
C16	H4	sing	1.09Å	1.10Å
C4	H5	sing	1.08Å	1.08Å
C5	H6	sing	1.08Å	1.08Å
C1	H7	sing	1.08Å	1.08Å
C14	H8	sing	1.09Å	1.10Å
C14	H9	sing	1.09Å	1.10Å
C15	H10	sing	1.09Å	1.10Å
C15	H11	sing	1.09Å	1.10Å
C15	H12	sing	1.09Å	1.10Å
C12	H13	sing	1.09Å	1.10Å
C12	H14	sing	1.09Å	1.10Å
C13	H15	sing	1.09Å	1.10Å
C13	H16	sing	1.09Å	1.10Å
C13	H17	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C16	C10	C9	118.4°	120.9°
C16	C10	C3	122.6°	120.9°
C10	C16	H2	109.5°	109.5°
C10	C16	H3	109.5°	109.4°
C10	C16	H4	109.5°	109.5°
C8	C9	C10	119.8°	119.8°
C9	C8	O17	122.4°	119.1°
C9	C8	O7	121.4°	121.7°
C8	C9	H1	120.1°	120.1°
C9	C10	C3	119.0°	118.2°
C10	C9	H1	120.1°	120.1°
O17	C8	O7	116.2°	119.2°
C8	O7	C2	124.3°	121.4°
C10	C3	C2	117.8°	119.0°
C10	C3	C4	126.2°	120.9°
O7	C2	C3	117.7°	119.8°
O7	C2	C1	120.7°	120.7°
C13	C12	N11	112.5°	109.5°
C13	C12	H13	108.7°	109.5°
C13	C12	H14	108.7°	109.5°
C12	C13	H15	109.5°	109.5°
C12	C13	H16	109.5°	109.5°
C12	C13	H17	109.5°	109.4°
C2	C3	C4	116.0°	120.1°
C3	C2	C1	121.6°	119.5°
C3	C4	C5	121.9°	119.8°
C3	C4	H5	119.0°	120.1°
C2	C1	C6	121.4°	119.8°
C2	C1	H7	119.3°	120.2°
C4	C5	C6	122.2°	120.4°
C5	C4	H5	119.1°	120.1°
C4	C5	H6	118.9°	119.8°
C15	C14	N11	113.7°	109.5°
C15	C14	H8	108.4°	109.4°
C15	C14	H9	108.4°	109.5°
C14	C15	H10	109.5°	109.5°
C14	C15	H11	109.5°	109.4°
C14	C15	H12	109.5°	109.5°
C1	C6	C5	116.9°	120.5°
C1	C6	N11	120.9°	119.7°
C6	C1	H7	119.3°	120.1°
C5	C6	N11	122.2°	119.8°
C6	C5	H6	118.9°	119.8°
C6	N11	C12	120.1°	120.0°
C6	N11	C14	123.0°	120.0°
C12	N11	C14	116.8°	120.0°
N11	C12	H13	108.7°	109.5°
N11	C12	H14	108.7°	109.4°
N11	C14	H8	108.4°	109.5°
N11	C14	H9	108.4°	109.5°
H2	C16	H3	109.4°	109.5°
H2	C16	H4	109.4°	109.5°
H3	C16	H4	109.5°	109.5°
H8	C14	H9	109.4°	109.4°
H10	C15	H11	109.5°	109.4°
H10	C15	H12	109.5°	109.5°
H11	C15	H12	109.5°	109.4°
H13	C12	H14	109.5°	109.5°
H15	C13	H16	109.5°	109.5°
H15	C13	H17	109.4°	109.5°
H16	C13	H17	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C16	C10	C9	C8	179.2°	180.0°
C16	C10	C9	C3	179.3°	180.0°
C16	C10	C3	C2	178.8°	179.8°
C16	C10	C3	C4	0.3°	0.0°
C16	C10	C9	H1	0.8°	0.0°
C10	C16	H2	H3	120.0°	120.0°
C10	C16	H2	H4	120.0°	120.0°
C10	C16	H3	H4	120.0°	120.0°
C8	C9	C10	H1	180.0°	180.0°
C9	C8	O17	O7	179.3°	179.8°
C8	C9	C10	C3	0.1°	0.0°
C9	C8	O7	C2	0.9°	0.3°
C10	C9	C8	O17	178.7°	180.0°
C10	C9	C8	O7	0.6°	0.3°
C9	C10	C3	C2	0.5°	0.3°
C9	C10	C3	C4	179.6°	180.0°
C9	C10	C16	H2	180.0°	0.0°
C9	C10	C16	H3	60.0°	120.0°
C9	C10	C16	H4	60.0°	120.0°
O17	C8	O7	C2	178.5°	180.0°
O17	C8	C9	H1	1.2°	0.0°
C8	O7	C2	C3	0.4°	0.0°
C8	O7	C2	C1	179.6°	180.0°
O7	C8	C9	H1	179.5°	179.7°
C10	C3	C2	O7	0.2°	0.3°
C10	C3	C2	C4	179.2°	179.7°
C10	C3	C2	C1	179.0°	179.7°
C10	C3	C4	C5	179.1°	180.0°
C3	C10	C9	H1	179.9°	180.0°
C3	C10	C16	H2	0.7°	180.0°
C3	C10	C16	H3	120.7°	60.0°
C3	C10	C16	H4	119.3°	60.0°
C10	C3	C4	H5	0.9°	0.0°
O7	C2	C3	C1	179.2°	180.0°
O7	C2	C3	C4	179.4°	180.0°
O7	C2	C1	C6	179.3°	179.5°
O7	C2	C1	H7	0.7°	0.0°
C13	C12	N11	C6	70.9°	90.0°
C13	C12	N11	H13	120.5°	120.0°
C13	C12	N11	H14	120.5°	120.0°
C13	C12	N11	C14	111.0°	90.0°
C13	C12	H13	H14	118.6°	120.1°
C12	C13	H15	H16	120.0°	120.0°
C12	C13	H15	H17	120.0°	120.0°
C12	C13	H16	H17	120.0°	120.0°
C2	C3	C4	C5	0.1°	0.3°
C3	C2	C1	C6	0.2°	0.5°
C2	C3	C4	H5	179.9°	179.7°
C3	C2	C1	H7	179.8°	180.0°
C4	C3	C2	C1	0.3°	0.0°
C3	C4	C5	H5	180.0°	180.0°
C3	C4	C5	C6	0.2°	0.0°
C3	C4	C5	H6	179.8°	180.0°
C2	C1	C6	H7	180.0°	179.5°
C2	C1	C6	C5	0.1°	0.7°
C2	C1	C6	N11	180.0°	179.8°
C4	C5	C6	C1	0.3°	0.5°
C4	C5	C6	H6	180.0°	180.0°
C4	C5	C6	N11	179.8°	180.0°
C15	C14	N11	C6	78.7°	90.0°
C15	C14	N11	C12	103.2°	90.0°
C15	C14	N11	H8	120.6°	120.0°
C15	C14	N11	H9	120.6°	120.0°
C15	C14	H8	H9	118.1°	120.0°
C14	C15	H10	H11	120.0°	120.0°
C14	C15	H10	H12	120.0°	120.1°
C14	C15	H11	H12	120.0°	120.0°
C1	C6	C5	N11	179.9°	179.5°
C1	C6	N11	C12	172.4°	179.5°
C1	C6	N11	C14	9.5°	0.5°
C1	C6	C5	H6	179.7°	179.5°
C5	C6	N11	C12	7.7°	0.0°
C5	C6	N11	C14	170.4°	180.0°
C6	C5	C4	H5	179.8°	180.0°
C5	C6	C1	H7	179.9°	179.8°
C6	N11	C12	C14	178.2°	180.0°
N11	C6	C5	H6	0.2°	0.0°
N11	C6	C1	H7	0.0°	0.3°
C6	N11	C14	H8	160.7°	150.0°
C6	N11	C14	H9	42.0°	30.0°
C6	N11	C12	H13	49.6°	150.0°
C6	N11	C12	H14	168.7°	30.0°
C12	N11	C14	H8	17.4°	30.0°
C12	N11	C14	H9	136.1°	150.0°
N11	C12	H13	H14	118.6°	120.0°
N11	C12	C13	H15	180.0°	180.0°
N11	C12	C13	H16	60.0°	60.0°
N11	C12	C13	H17	60.0°	60.0°
N11	C14	H8	H9	118.1°	120.0°
N11	C14	C15	H10	180.0°	180.0°
N11	C14	C15	H11	60.0°	60.0°
N11	C14	C15	H12	60.0°	60.0°
C14	N11	C12	H13	128.6°	29.9°
C14	N11	C12	H14	9.5°	150.0°
H2	C16	H3	H4	119.9°	120.1°
H5	C4	C5	H6	0.2°	0.0°
H8	C14	C15	H10	59.4°	60.0°
H8	C14	C15	H11	60.6°	NaN°
H8	C14	C15	H12	179.3°	60.0°
H9	C14	C15	H10	59.4°	59.9°
H9	C14	C15	H11	179.3°	60.1°
H9	C14	C15	H12	60.6°	180.0°
H10	C15	H11	H12	120.0°	120.0°
H13	C12	C13	H15	59.6°	60.0°
H13	C12	C13	H16	60.4°	180.0°
H13	C12	C13	H17	179.6°	60.0°
H14	C12	C13	H15	59.5°	60.1°
H14	C12	C13	H16	179.6°	59.9°
H14	C12	C13	H17	60.5°	179.9°
H15	C13	H16	H17	119.9°	120.0°

Release date:	2017-03-08
Definition date:	2016-08-03
Last modified:	2017-03-03
Release status:	REL
Processing site:	RCSB
Derived from:	5L2O