6KO

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C14	C13	sing	1.54Å	1.51Å
C14	C15	sing	1.55Å	1.52Å
N21	C20	doub	1.32Å	1.34Å	Aromatic
N21	C22	sing	1.34Å	1.46Å	Aromatic
C20	C19	sing	1.39Å	1.38Å	Aromatic
C3	C4	doub	1.38Å	1.38Å	Aromatic
C3	C2	sing	1.39Å	1.38Å	Aromatic
C22	N23	doub	1.33Å	1.34Å	Aromatic
C22	N26	sing	1.37Å	1.33Å	Aromatic
C13	N17	sing	1.47Å	1.45Å
C13	C12	sing	1.53Å	1.51Å
N23	C24	sing	1.33Å	1.38Å	Aromatic
C19	C18	doub	1.38Å	1.39Å	Aromatic
C16	C15	sing	1.55Å	1.50Å
C16	N17	sing	1.48Å	1.44Å
N26	C18	sing	1.37Å	1.47Å	Aromatic
N26	N25	sing	1.40Å	1.37Å	Aromatic
C24	N25	doub	1.31Å	1.29Å	Aromatic
C18	N17	sing	1.38Å	1.41Å
C4	C5	sing	1.40Å	1.38Å	Aromatic
C2	C1	doub	1.38Å	1.38Å	Aromatic
O11	C12	sing	1.45Å	1.43Å
O11	C9	sing	1.35Å	1.36Å
C5	C9	sing	1.47Å	1.48Å
C5	C6	doub	1.40Å	1.38Å	Aromatic
C1	C6	sing	1.39Å	1.38Å	Aromatic
C9	O10	doub	1.22Å	1.23Å
C6	O7	sing	1.36Å	1.39Å
O7	C8	sing	1.43Å	1.43Å
C4	H1	sing	1.08Å	1.08Å
C8	H2	sing	1.09Å	1.10Å
C8	H3	sing	1.09Å	1.10Å
C8	H4	sing	1.09Å	1.10Å
C13	H5	sing	1.09Å	1.10Å
C15	H6	sing	1.09Å	1.10Å
C15	H7	sing	1.09Å	1.10Å
C20	H8	sing	1.08Å	1.08Å
C24	H9	sing	1.08Å	1.08Å
C12	H10	sing	1.09Å	1.10Å
C12	H11	sing	1.09Å	1.10Å
C14	H12	sing	1.09Å	1.10Å
C14	H13	sing	1.09Å	1.10Å
C16	H14	sing	1.09Å	1.10Å
C16	H15	sing	1.09Å	1.10Å
C19	H16	sing	1.08Å	1.08Å
C1	H17	sing	1.08Å	1.08Å
C2	H18	sing	1.08Å	1.08Å
C3	H19	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C13	C14	C15	105.8°	102.9°
C14	C13	N17	102.8°	107.3°
C14	C13	C12	106.9°	109.8°
C14	C13	H5	112.1°	110.0°
C13	C14	H12	110.4°	110.7°
C13	C14	H13	110.4°	110.8°
C14	C15	C16	104.5°	101.6°
C14	C15	H6	110.7°	111.0°
C14	C15	H7	110.7°	111.0°
C15	C14	H12	110.4°	110.7°
C15	C14	H13	110.4°	110.7°
C20	N21	C22	113.2°	121.2°
N21	C20	C19	126.3°	120.4°
N21	C20	H8	116.8°	119.8°
N21	C22	N23	128.5°	132.4°
N21	C22	N26	123.7°	120.5°
C20	C19	C18	121.2°	119.0°
C19	C20	H8	116.9°	119.8°
C20	C19	H16	119.4°	120.4°
C4	C3	C2	119.7°	120.3°
C3	C4	C5	119.9°	119.9°
C3	C4	H1	120.1°	120.1°
C4	C3	H19	120.2°	119.8°
C3	C2	C1	120.3°	120.4°
C3	C2	H18	119.9°	119.8°
C2	C3	H19	120.1°	119.9°
N23	C22	N26	107.8°	107.1°
C22	N23	C24	104.5°	109.8°
C22	N26	C18	120.8°	120.1°
C22	N26	N25	111.0°	106.5°
N17	C13	C12	109.6°	109.9°
C13	N17	C16	114.3°	108.7°
C13	N17	C18	122.3°	125.6°
N17	C13	H5	112.9°	109.9°
C13	C12	O11	109.0°	109.5°
C12	C13	H5	112.0°	109.9°
C13	C12	H10	109.6°	109.5°
C13	C12	H11	109.6°	109.4°
N23	C24	N25	113.2°	109.6°
N23	C24	H9	123.4°	125.2°
C19	C18	N26	114.8°	118.7°
C19	C18	N17	122.7°	120.6°
C18	C19	H16	119.4°	120.5°
C15	C16	N17	101.7°	104.8°
C16	C15	H6	110.7°	111.0°
C16	C15	H7	110.7°	111.0°
C15	C16	H14	111.4°	110.4°
C15	C16	H15	111.4°	110.4°
C16	N17	C18	116.2°	125.7°
N17	C16	H14	111.4°	110.3°
N17	C16	H15	111.4°	110.4°
C18	N26	N25	128.1°	133.4°
N26	C18	N17	122.5°	120.6°
N26	N25	C24	103.5°	107.0°
N25	C24	H9	123.4°	125.2°
C4	C5	C9	119.0°	120.2°
C4	C5	C6	120.6°	119.7°
C5	C4	H1	120.0°	120.0°
C2	C1	C6	120.2°	120.1°
C2	C1	H17	119.9°	120.0°
C1	C2	H18	119.8°	119.8°
C12	O11	C9	110.5°	117.0°
O11	C12	H10	109.6°	109.5°
O11	C12	H11	109.6°	109.5°
O11	C9	C5	106.7°	119.9°
O11	C9	O10	128.2°	120.0°
C9	C5	C6	120.4°	120.1°
C5	C9	O10	125.0°	120.0°
C5	C6	C1	119.4°	119.6°
C5	C6	O7	119.3°	120.2°
C1	C6	O7	121.3°	120.2°
C6	C1	H17	119.9°	119.9°
C6	O7	C8	107.7°	117.0°
O7	C8	H2	109.5°	109.5°
O7	C8	H3	109.4°	109.4°
O7	C8	H4	109.5°	109.4°
H2	C8	H3	109.5°	109.5°
H2	C8	H4	109.4°	109.5°
H3	C8	H4	109.5°	109.5°
H6	C15	H7	109.5°	110.9°
H10	C12	H11	109.5°	109.5°
H12	C14	H13	109.5°	110.8°
H14	C16	H15	109.5°	110.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C13	C14	C15	H12	119.4°	118.4°
C13	C14	C15	H13	119.4°	118.4°
C14	C13	N17	C12	113.4°	119.4°
C14	C13	N17	H5	121.0°	119.6°
C14	C13	C12	H5	123.1°	121.1°
C13	C14	C15	C16	30.9°	35.5°
C14	C13	N17	C16	4.3°	1.0°
C14	C13	N17	C18	153.4°	179.0°
C14	C13	C12	O11	78.9°	52.8°
C13	C14	C15	H6	150.1°	82.6°
C13	C14	C15	H7	88.2°	153.6°
C14	C13	C12	H10	161.2°	67.2°
C14	C13	C12	H11	41.0°	172.8°
C13	C14	H12	H13	121.6°	123.3°
C15	C14	C13	N17	16.7°	22.2°
C15	C14	C13	C12	98.7°	141.6°
C14	C15	C16	H6	119.2°	118.1°
C14	C15	C16	H7	119.2°	118.1°
C14	C15	C16	N17	32.0°	37.0°
C15	C14	C13	H5	138.2°	97.3°
C14	C15	H6	H7	122.3°	123.8°
C15	C14	H12	H13	121.7°	123.2°
C14	C15	C16	H14	86.7°	155.8°
C14	C15	C16	H15	150.8°	81.8°
N21	C20	C19	H8	180.0°	179.7°
C20	N21	C22	N23	179.6°	180.0°
C20	N21	C22	N26	0.0°	0.0°
N21	C20	C19	C18	0.0°	0.3°
N21	C20	C19	H16	180.0°	179.7°
C22	N21	C20	C19	0.2°	0.0°
N21	C22	N23	N26	179.6°	180.0°
N21	C22	N23	C24	179.7°	180.0°
N21	C22	N26	C18	0.4°	0.3°
N21	C22	N26	N25	179.9°	180.0°
C22	N21	C20	H8	179.8°	179.7°
C20	C19	C18	H16	180.0°	180.0°
C20	C19	C18	N26	0.4°	0.5°
C20	C19	C18	N17	179.3°	180.0°
C4	C3	C2	H19	180.0°	179.4°
C3	C4	C5	H1	180.0°	179.7°
C4	C3	C2	C1	0.0°	0.6°
C3	C4	C5	C9	179.9°	179.8°
C3	C4	C5	C6	0.1°	0.2°
C4	C3	C2	H18	179.9°	179.7°
C2	C3	C4	C5	0.1°	0.6°
C3	C2	C1	H18	180.0°	179.7°
C3	C2	C1	C6	0.2°	0.4°
C2	C3	C4	H1	180.0°	179.7°
C3	C2	C1	H17	179.9°	179.7°
N23	C22	N26	C18	180.0°	179.7°
N23	C22	N26	N25	0.2°	0.0°
C22	N23	C24	N25	0.0°	0.0°
C22	N23	C24	H9	179.9°	179.9°
N26	C22	N23	C24	0.1°	0.0°
C22	N26	C18	C19	0.6°	0.6°
C22	N26	C18	N25	179.7°	179.5°
C22	N26	N25	C24	0.2°	0.0°
C22	N26	C18	N17	179.5°	180.0°
N17	C13	C12	H5	126.1°	121.1°
C13	N17	C18	C19	160.4°	0.0°
C13	N17	C16	C15	23.2°	24.1°
C13	N17	C16	C18	151.1°	180.0°
C13	N17	C18	N26	20.8°	179.4°
N17	C13	C12	O11	170.4°	65.0°
N17	C13	C12	H10	50.4°	175.0°
N17	C13	C12	H11	69.7°	55.0°
N17	C13	C14	H12	102.7°	140.6°
N17	C13	C14	H13	136.1°	96.2°
C13	N17	C16	H14	95.6°	142.9°
C13	N17	C16	H15	141.9°	94.7°
C12	C13	N17	C16	117.7°	118.3°
C12	C13	N17	C18	93.2°	61.6°
C13	C12	O11	H10	119.9°	120.0°
C13	C12	O11	H11	119.9°	120.0°
C13	C12	O11	C9	172.9°	180.0°
C13	C12	H10	H11	120.2°	120.0°
C12	C13	C14	H12	141.9°	100.0°
C12	C13	C14	H13	20.8°	23.2°
N23	C24	N25	N26	0.2°	0.0°
N23	C24	N25	H9	180.0°	179.9°
C19	C18	N17	C16	11.8°	179.9°
C19	C18	N26	N17	178.9°	179.5°
C19	C18	N26	N25	179.7°	179.9°
C18	C19	C20	H8	180.0°	180.0°
C15	C16	N17	H14	118.8°	118.8°
C15	C16	N17	H15	118.7°	118.9°
C15	C16	N17	C18	174.3°	155.9°
C16	C15	H6	H7	122.3°	123.9°
C16	C15	C14	H12	88.5°	153.9°
C16	C15	C14	H13	150.4°	82.9°
C15	C16	H14	H15	123.6°	122.3°
C16	N17	C18	N26	169.4°	0.5°
C16	N17	C13	H5	116.7°	120.6°
N17	C16	C15	H6	151.3°	81.1°
N17	C16	C15	H7	87.1°	155.1°
N17	C16	H14	H15	123.6°	122.3°
C18	N26	N25	C24	180.0°	179.6°
N26	C18	C19	H16	179.6°	179.5°
N25	N26	C18	N17	0.9°	0.4°
N26	N25	C24	H9	179.8°	179.9°
C18	N17	C13	H5	32.5°	59.4°
C18	N17	C16	H14	55.5°	37.1°
C18	N17	C16	H15	67.0°	85.2°
N17	C18	C19	H16	0.7°	0.0°
C4	C5	C9	O11	15.6°	0.0°
C4	C5	C9	C6	180.0°	180.0°
C4	C5	C6	C1	0.3°	0.0°
C4	C5	C9	O10	163.5°	179.9°
C4	C5	C6	O7	179.9°	180.0°
C5	C4	C3	H19	179.9°	179.9°
C2	C1	C6	C5	0.3°	0.0°
C2	C1	C6	H17	180.0°	179.9°
C2	C1	C6	O7	179.9°	179.9°
C1	C2	C3	H19	180.0°	180.0°
C12	O11	C9	C5	180.0°	180.0°
C12	O11	C9	O10	0.9°	0.1°
O11	C12	C13	H5	44.2°	173.9°
O11	C12	H10	H11	120.2°	120.0°
O11	C9	C5	O10	179.1°	179.9°
O11	C9	C5	C6	164.4°	180.0°
C9	O11	C12	H10	53.0°	60.0°
C9	O11	C12	H11	67.1°	60.0°
C9	C5	C6	C1	179.7°	179.9°
C9	C5	C6	O7	0.1°	0.0°
C9	C5	C4	H1	0.1°	0.0°
C5	C6	C1	O7	179.6°	180.0°
C6	C5	C9	O10	16.5°	0.1°
C5	C6	O7	C8	154.8°	180.0°
C6	C5	C4	H1	179.9°	180.0°
C5	C6	C1	H17	179.7°	180.0°
C1	C6	O7	C8	25.6°	0.0°
C6	C1	C2	H18	179.9°	180.0°
C6	O7	C8	H2	180.0°	180.0°
C6	O7	C8	H3	60.0°	60.0°
C6	O7	C8	H4	60.0°	60.0°
O7	C6	C1	H17	0.1°	0.0°
O7	C8	H2	H3	120.0°	120.0°
O7	C8	H2	H4	120.0°	120.0°
O7	C8	H3	H4	120.0°	119.9°
H1	C4	C3	H19	0.0°	0.3°
H2	C8	H3	H4	120.0°	120.1°
H5	C13	C12	H10	75.7°	53.9°
H5	C13	C12	H11	164.2°	66.1°
H5	C13	C14	H12	18.8°	21.0°
H5	C13	C14	H13	102.3°	144.3°
H6	C15	C14	H12	30.7°	35.8°
H6	C15	C14	H13	90.5°	159.0°
H6	C15	C16	H14	32.5°	37.7°
H6	C15	C16	H15	90.0°	160.1°
H7	C15	C14	H12	152.4°	88.0°
H7	C15	C14	H13	31.2°	35.2°
H7	C15	C16	H14	154.1°	86.1°
H7	C15	C16	H15	31.6°	36.2°
H8	C20	C19	H16	0.0°	0.0°
H17	C1	C2	H18	0.1°	0.0°
H18	C2	C3	H19	0.1°	0.3°

Release date:	2016-05-25
Definition date:	2016-04-22
Last modified:	2016-05-20
Release status:	REL
Processing site:	RCSB
Derived from:	5JHU