U9Y

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N25	C21	sing	1.47Å	1.58Å
C22	C21	sing	1.53Å	1.52Å
C22	C23	sing	1.53Å	1.53Å
C24	C21	sing	1.53Å	1.52Å
C21	C20	sing	1.53Å	1.53Å
C23	N18	sing	1.47Å	1.49Å
C16	N17	doub	1.32Å	1.34Å	Aromatic
C16	C15	sing	1.40Å	1.46Å	Aromatic
C20	C19	sing	1.53Å	1.55Å
CL8	C04	sing	1.74Å	1.73Å
N18	C15	sing	1.39Å	1.48Å
N18	C19	sing	1.47Å	1.49Å
N17	C13	sing	1.33Å	1.36Å	Aromatic
C15	N14	doub	1.32Å	1.35Å	Aromatic
CL7	C05	sing	1.74Å	1.70Å
C04	C03	doub	1.38Å	1.39Å	Aromatic
C04	C05	sing	1.38Å	1.40Å	Aromatic
C03	C02	sing	1.38Å	1.40Å	Aromatic
C05	C06	doub	1.40Å	1.40Å	Aromatic
C13	C09	sing	1.47Å	1.49Å	Aromatic
C13	C12	doub	1.41Å	1.48Å	Aromatic
C02	C01	doub	1.38Å	1.41Å	Aromatic
N14	C12	sing	1.33Å	1.38Å	Aromatic
C06	C01	sing	1.39Å	1.42Å	Aromatic
C06	C09	sing	1.48Å	1.58Å
C09	N10	doub	1.31Å	1.35Å	Aromatic
C12	N11	sing	1.37Å	1.35Å	Aromatic
N11	N10	sing	1.40Å	1.36Å	Aromatic
C01	H1	sing	1.08Å	1.08Å
C02	H2	sing	1.08Å	1.08Å
C03	H3	sing	1.08Å	1.08Å
C16	H4	sing	1.08Å	1.08Å
C19	H5	sing	1.09Å	1.10Å
C19	H6	sing	1.09Å	1.10Å
C20	H7	sing	1.09Å	1.10Å
C20	H8	sing	1.09Å	1.10Å
C22	H9	sing	1.09Å	1.10Å
C22	H10	sing	1.09Å	1.10Å
C23	H11	sing	1.09Å	1.10Å
C23	H12	sing	1.09Å	1.10Å
C24	H13	sing	1.09Å	1.10Å
C24	H14	sing	1.09Å	1.10Å
C24	H15	sing	1.09Å	1.10Å
N11	H16	sing	0.97Å	1.00Å
N25	H17	sing	1.01Å	1.00Å
N25	H18	sing	1.01Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
N25	C21	C22	107.4°	109.6°
N25	C21	C24	107.3°	109.6°
N25	C21	C20	108.3°	109.5°
C21	N25	H17	109.5°	111.0°
C21	N25	H18	109.5°	111.0°
C21	C22	C23	110.1°	109.3°
C22	C21	C24	109.2°	109.5°
C22	C21	C20	111.4°	109.2°
C21	C22	H9	109.3°	109.5°
C21	C22	H10	109.3°	109.5°
C22	C23	N18	113.0°	109.5°
C23	C22	H9	109.3°	109.5°
C23	C22	H10	109.3°	109.5°
C22	C23	H11	108.6°	109.4°
C22	C23	H12	108.6°	109.5°
C24	C21	C20	113.0°	109.5°
C21	C24	H13	109.5°	109.5°
C21	C24	H14	109.5°	109.4°
C21	C24	H15	109.5°	109.5°
C21	C20	C19	110.6°	109.3°
C21	C20	H7	109.2°	109.5°
C21	C20	H8	109.2°	109.5°
C23	N18	C15	122.0°	111.0°
C23	N18	C19	108.4°	111.2°
N18	C23	H11	108.6°	109.4°
N18	C23	H12	108.6°	109.5°
N17	C16	C15	126.3°	120.3°
C16	N17	C13	120.1°	119.8°
N17	C16	H4	116.9°	119.8°
C16	C15	N18	120.6°	119.8°
C16	C15	N14	115.1°	120.4°
C15	C16	H4	116.8°	119.8°
C20	C19	N18	114.9°	109.6°
C20	C19	H5	108.1°	109.5°
C20	C19	H6	108.1°	109.4°
C19	C20	H7	109.2°	109.5°
C19	C20	H8	109.2°	109.5°
CL8	C04	C03	115.4°	120.0°
CL8	C04	C05	121.8°	119.9°
C15	N18	C19	117.9°	111.0°
N18	C15	N14	124.2°	119.8°
N18	C19	H5	108.1°	109.5°
N18	C19	H6	108.1°	109.4°
N17	C13	C09	137.4°	133.7°
N17	C13	C12	114.4°	120.0°
C15	N14	C12	119.3°	119.8°
CL7	C05	C04	116.5°	120.1°
CL7	C05	C06	118.3°	120.1°
C03	C04	C05	122.7°	120.1°
C04	C03	C02	114.5°	120.3°
C04	C03	H3	122.8°	119.9°
C04	C05	C06	125.2°	119.8°
C03	C02	C01	121.7°	120.2°
C03	C02	H2	119.2°	119.9°
C02	C03	H3	122.8°	119.8°
C05	C06	C01	110.6°	119.7°
C05	C06	C09	123.2°	120.1°
C09	C13	C12	108.2°	106.2°
C13	C09	C06	131.1°	126.2°
C13	C09	N10	105.5°	107.5°
C13	C12	N14	124.9°	119.7°
C13	C12	N11	100.7°	106.9°
C02	C01	C06	125.2°	119.9°
C02	C01	H1	117.4°	120.1°
C01	C02	H2	119.2°	119.9°
N14	C12	N11	134.4°	133.4°
C01	C06	C09	126.2°	120.2°
C06	C01	H1	117.4°	120.0°
C06	C09	N10	123.4°	126.3°
C09	N10	N11	108.0°	109.9°
C12	N11	N10	117.6°	109.4°
C12	N11	H16	121.2°	125.3°
N10	N11	H16	121.2°	125.3°
H5	C19	H6	109.5°	109.4°
H7	C20	H8	109.5°	109.5°
H9	C22	H10	109.5°	109.5°
H11	C23	H12	109.5°	109.4°
H13	C24	H14	109.4°	109.4°
H13	C24	H15	109.4°	109.5°
H14	C24	H15	109.5°	109.5°
H17	N25	H18	109.5°	111.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N25	C21	C22	C24	116.0°	120.2°
N25	C21	C22	C20	118.5°	119.9°
N25	C21	C22	C23	172.9°	62.3°
N25	C21	C24	C20	119.3°	120.2°
N25	C21	C20	C19	168.9°	62.3°
N25	C21	C20	H7	71.0°	57.7°
N25	C21	C20	H8	48.7°	177.7°
N25	C21	C22	H9	52.8°	57.7°
N25	C21	C22	H10	67.0°	177.8°
N25	C21	C24	H13	180.0°	179.9°
N25	C21	C24	H14	60.0°	59.9°
N25	C21	C24	H15	60.0°	60.1°
C21	N25	H17	H18	120.1°	123.9°
C21	C22	C23	H9	120.1°	120.0°
C21	C22	C23	H10	120.1°	119.9°
C22	C21	C24	C20	124.6°	119.6°
C21	C22	C23	N18	58.9°	59.1°
C22	C21	C20	C19	51.0°	57.7°
C22	C21	C20	H7	171.2°	177.6°
C22	C21	C20	H8	69.1°	62.3°
C21	C22	H9	H10	119.7°	120.1°
C21	C22	C23	H11	179.4°	60.8°
C21	C22	C23	H12	61.6°	179.2°
C22	C21	C24	H13	64.0°	59.6°
C22	C21	C24	H14	56.0°	60.3°
C22	C21	C24	H15	176.1°	179.7°
C22	C21	N25	H17	180.0°	60.3°
C22	C21	N25	H18	60.0°	63.7°
C23	C22	C21	C24	71.1°	177.5°
C23	C22	C21	C20	54.4°	57.7°
C22	C23	N18	H11	120.5°	120.0°
C22	C23	N18	H12	120.5°	120.1°
C22	C23	N18	C15	84.7°	174.1°
C22	C23	N18	C19	57.5°	61.7°
C23	C22	H9	H10	119.7°	120.1°
C22	C23	H11	H12	118.4°	119.9°
C24	C21	C20	C19	72.4°	177.5°
C24	C21	C20	H7	47.8°	62.5°
C24	C21	C20	H8	167.5°	57.5°
C24	C21	C22	H9	168.8°	62.5°
C24	C21	C22	H10	49.0°	57.6°
C21	C24	H13	H14	120.0°	120.0°
C21	C24	H13	H15	120.0°	120.1°
C21	C24	H14	H15	120.0°	120.0°
C24	C21	N25	H17	62.8°	59.9°
C24	C21	N25	H18	57.3°	176.2°
C21	C20	C19	H7	120.1°	119.9°
C21	C20	C19	H8	120.1°	120.0°
C21	C20	C19	N18	52.5°	59.2°
C21	C20	C19	H5	68.3°	179.3°
C21	C20	C19	H6	173.3°	60.8°
C21	C20	H7	H8	119.5°	120.1°
C20	C21	C22	H9	65.7°	177.6°
C20	C21	C22	H10	174.5°	62.2°
C20	C21	C24	H13	60.7°	60.0°
C20	C21	C24	H14	179.4°	180.0°
C20	C21	C24	H15	59.3°	60.0°
C20	C21	N25	H17	59.5°	180.0°
C20	C21	N25	H18	179.6°	56.0°
C23	N18	C15	C16	44.8°	179.8°
C23	N18	C19	C20	54.7°	61.7°
C23	N18	C15	C19	138.9°	124.3°
C23	N18	C15	N14	135.5°	0.0°
C23	N18	C19	H5	66.1°	178.2°
C23	N18	C19	H6	175.5°	58.3°
N18	C23	C22	H9	61.2°	179.1°
N18	C23	C22	H10	179.0°	60.8°
N18	C23	H11	H12	118.4°	120.0°
N17	C16	C15	H4	180.0°	179.8°
N17	C16	C15	N18	179.7°	179.8°
N17	C16	C15	N14	0.1°	0.1°
C16	N17	C13	C09	179.6°	180.0°
C16	N17	C13	C12	0.1°	0.1°
C16	C15	N18	N14	179.6°	179.9°
C16	C15	N18	C19	176.3°	55.9°
C15	C16	N17	C13	0.1°	0.1°
C16	C15	N14	C12	0.0°	0.2°
C20	C19	N18	C15	89.3°	174.1°
C20	C19	N18	H5	120.8°	120.1°
C20	C19	N18	H6	120.8°	119.9°
C20	C19	H5	H6	117.5°	119.9°
C19	C20	H7	H8	119.5°	120.1°
CL8	C04	C05	CL7	0.1°	0.0°
CL8	C04	C03	C05	179.7°	180.0°
CL8	C04	C03	C02	179.7°	179.9°
CL8	C04	C05	C06	180.0°	179.7°
CL8	C04	C03	H3	0.3°	0.1°
N18	C15	N14	C12	179.6°	179.9°
N18	C15	C16	H4	0.2°	0.0°
C15	N18	C19	H5	149.9°	54.0°
C15	N18	C19	H6	31.5°	65.9°
C15	N18	C23	H11	35.8°	65.9°
C15	N18	C23	H12	154.8°	54.1°
C19	N18	C15	N14	3.3°	124.2°
N18	C19	H5	H6	117.5°	119.9°
N18	C19	C20	H7	172.7°	179.1°
N18	C19	C20	H8	67.6°	60.8°
C19	N18	C23	H11	178.0°	58.3°
C19	N18	C23	H12	63.0°	178.3°
N17	C13	C09	C12	179.7°	179.9°
N17	C13	C12	N14	0.0°	0.4°
N17	C13	C09	C06	0.5°	0.1°
N17	C13	C09	N10	179.6°	179.9°
N17	C13	C12	N11	179.9°	180.0°
C13	N17	C16	H4	179.8°	179.9°
C15	N14	C12	C13	0.1°	0.4°
C15	N14	C12	N11	179.8°	180.0°
N14	C15	C16	H4	179.9°	179.9°
CL7	C05	C04	C03	179.8°	180.0°
CL7	C05	C04	C06	179.9°	179.8°
CL7	C05	C06	C01	179.8°	179.8°
CL7	C05	C06	C09	0.6°	0.2°
C04	C03	C02	H3	180.0°	180.0°
C03	C04	C05	C06	0.3°	0.2°
C04	C03	C02	C01	0.1°	0.0°
C04	C03	C02	H2	179.9°	179.9°
C05	C04	C03	C02	0.1°	0.0°
C04	C05	C06	C01	0.3°	0.5°
C04	C05	C06	C09	179.4°	180.0°
C05	C04	C03	H3	180.0°	180.0°
C03	C02	C01	H2	180.0°	179.9°
C03	C02	C01	C06	0.1°	0.3°
C03	C02	C01	H1	179.9°	180.0°
C05	C06	C09	C13	126.8°	180.0°
C05	C06	C01	C02	0.1°	0.5°
C05	C06	C01	C09	179.1°	179.5°
C05	C06	C09	N10	52.2°	0.0°
C05	C06	C01	H1	179.9°	179.7°
C09	C13	C12	N14	179.8°	179.7°
C13	C09	C06	C01	52.2°	0.4°
C13	C09	C06	N10	178.9°	180.0°
C09	C13	C12	N11	0.4°	0.1°
C13	C09	N10	N11	0.7°	0.0°
C13	C12	N14	N11	179.7°	179.5°
C12	C13	C09	C06	179.8°	179.9°
C12	C13	C09	N10	0.7°	0.1°
C13	C12	N11	N10	0.1°	0.1°
C13	C12	N11	H16	179.9°	180.0°
C02	C01	C06	H1	180.0°	179.8°
C02	C01	C06	C09	179.2°	180.0°
C01	C02	C03	H3	179.9°	180.0°
N14	C12	N11	N10	179.7°	179.6°
N14	C12	N11	H16	0.3°	0.4°
C01	C06	C09	N10	128.8°	179.5°
C06	C01	C02	H2	179.9°	179.8°
C06	C09	N10	N11	179.9°	180.0°
C09	C06	C01	H1	0.8°	0.2°
C09	N10	N11	C12	0.6°	0.0°
C09	N10	N11	H16	179.4°	180.0°
C12	N11	N10	H16	180.0°	179.9°
H1	C01	C02	H2	0.1°	0.1°
H2	C02	C03	H3	0.2°	0.0°
H5	C19	C20	H7	51.9°	60.8°
H5	C19	C20	H8	171.6°	59.3°
H6	C19	C20	H7	66.6°	59.1°
H6	C19	C20	H8	53.1°	179.2°
H9	C22	C23	H11	59.3°	59.1°
H9	C22	C23	H12	178.3°	60.8°
H10	C22	C23	H11	60.5°	179.3°
H10	C22	C23	H12	58.4°	59.3°
H13	C24	H14	H15	120.0°	119.9°

Release date:	2021-03-17
Definition date:	2020-05-05
Last modified:	2021-03-12
Release status:	REL
Processing site:	RCSB
Derived from:	6WU8