A1L67

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N09	C19	sing	1.38Å	1.45Å
N08	C20	doub	1.32Å	1.26Å	Aromatic
N08	C19	sing	1.33Å	1.27Å	Aromatic
C20	N07	sing	1.32Å	1.34Å	Aromatic
C19	C17	doub	1.40Å	1.37Å	Aromatic
O03	C12	sing	1.43Å	1.43Å
N07	C15	doub	1.33Å	1.40Å	Aromatic
C17	C15	sing	1.41Å	1.64Å	Aromatic
C17	N06	sing	1.36Å	1.51Å	Aromatic
C15	N05	sing	1.37Å	1.51Å	Aromatic
C11	C12	sing	1.55Å	1.51Å
C11	O02	sing	1.43Å	1.43Å
C11	C10	sing	1.55Å	1.51Å
C12	C14	sing	1.52Å	1.51Å
N06	C16	doub	1.30Å	1.32Å	Aromatic
C18	C14	doub	1.32Å	1.34Å
N05	C16	sing	1.36Å	1.33Å	Aromatic
N05	C10	sing	1.46Å	1.46Å
C14	O01	sing	1.36Å	1.49Å
C10	O01	sing	1.44Å	1.46Å
C10	C13	sing	1.53Å	1.57Å
C13	O04	sing	1.43Å	1.41Å
C11	H1	sing	1.09Å	1.10Å
C12	H2	sing	1.09Å	1.10Å
C13	H3	sing	1.09Å	1.10Å
C13	H4	sing	1.09Å	1.10Å
C16	H5	sing	1.08Å	1.08Å
C18	H7	sing	1.08Å	1.08Å
C18	H8	sing	1.08Å	1.08Å
C20	H9	sing	1.08Å	1.08Å
N09	H11	sing	0.97Å	1.00Å
N09	H12	sing	0.97Å	1.00Å
O02	H13	sing	0.97Å	0.95Å
O03	H14	sing	0.97Å	0.95Å
O04	H15	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
N09	C19	N08	117.1°	120.8°
N09	C19	C17	113.9°	120.8°
C19	N09	H11	109.5°	120.0°
C19	N09	H12	109.5°	120.0°
C20	N08	C19	125.7°	121.3°
N08	C20	N07	116.5°	122.5°
N08	C20	H9	121.7°	118.8°
N08	C19	C17	129.0°	118.4°
C20	N07	C15	127.7°	120.6°
N07	C20	H9	121.8°	118.7°
C19	C17	C15	109.0°	118.2°
C19	C17	N06	146.8°	134.7°
O03	C12	C11	115.4°	110.5°
O03	C12	C14	110.7°	110.5°
O03	C12	H2	109.3°	110.6°
C12	O03	H14	109.5°	114.0°
N07	C15	C17	112.1°	119.0°
N07	C15	N05	145.0°	134.9°
C15	C17	N06	104.2°	107.1°
C17	C15	N05	102.9°	106.0°
C17	N06	C16	101.8°	109.4°
C15	N05	C16	102.5°	107.4°
C15	N05	C10	129.3°	126.3°
C12	C11	O02	109.5°	111.2°
C12	C11	C10	107.3°	101.0°
C11	C12	C14	104.4°	104.0°
C12	C11	H1	109.9°	111.1°
C11	C12	H2	108.4°	110.5°
O02	C11	C10	109.4°	111.1°
O02	C11	H1	110.9°	111.0°
C11	O02	H13	109.5°	113.9°
C11	C10	N05	115.5°	110.9°
C11	C10	O01	104.7°	102.7°
C11	C10	C13	109.1°	110.8°
C10	C11	H1	109.8°	111.1°
C12	C14	C18	129.0°	125.6°
C12	C14	O01	102.2°	108.7°
C14	C12	H2	108.3°	110.5°
N06	C16	N05	124.5°	110.0°
N06	C16	H5	117.8°	125.0°
C18	C14	O01	128.8°	125.6°
C14	C18	H7	120.0°	120.0°
C14	C18	H8	120.0°	120.0°
C16	N05	C10	127.2°	126.3°
N05	C16	H5	117.8°	125.0°
N05	C10	O01	107.6°	110.7°
N05	C10	C13	109.5°	110.7°
C14	O01	C10	107.9°	108.1°
O01	C10	C13	110.4°	110.8°
C10	C13	O04	109.6°	109.4°
C10	C13	H3	109.5°	109.5°
C10	C13	H4	109.5°	109.5°
O04	C13	H3	109.4°	109.5°
O04	C13	H4	109.4°	109.5°
C13	O04	H15	109.5°	113.9°
H3	C13	H4	109.4°	109.5°
H7	C18	H8	120.0°	120.0°
H11	N09	H12	109.4°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N09	C19	N08	C20	179.8°	179.9°
N09	C19	N08	C17	179.5°	180.0°
N09	C19	C17	C15	179.9°	179.9°
N09	C19	C17	N06	1.9°	0.0°
C19	N09	H11	H12	120.0°	179.9°
N08	C20	N07	H9	180.0°	179.9°
C20	N08	C19	C17	0.3°	0.2°
N08	C20	N07	C15	0.3°	0.1°
C19	N08	C20	N07	0.1°	0.1°
N08	C19	C17	C15	0.4°	0.1°
N08	C19	C17	N06	177.6°	180.0°
C19	N08	C20	H9	179.9°	179.8°
N08	C19	N09	H11	0.0°	180.0°
N08	C19	N09	H12	120.0°	0.0°
C20	N07	C15	C17	0.1°	0.3°
C20	N07	C15	N05	179.9°	179.9°
C19	C17	C15	N07	0.2°	0.3°
C19	C17	C15	N06	178.9°	179.9°
C19	C17	C15	N05	179.7°	180.0°
C19	C17	N06	C16	168.7°	180.0°
C17	C19	N09	H11	179.6°	0.1°
C17	C19	N09	H12	59.6°	180.0°
O03	C12	C11	C14	121.8°	118.6°
O03	C12	C11	H2	123.0°	122.8°
O03	C12	C11	O02	99.9°	143.1°
O03	C12	C11	C10	141.5°	99.0°
O03	C12	C14	H2	119.9°	122.7°
O03	C12	C14	C18	20.9°	58.1°
O03	C12	C14	O01	158.5°	122.0°
O03	C12	C11	H1	22.1°	18.9°
N07	C15	C17	N05	179.9°	179.7°
N07	C15	C17	N06	178.7°	179.8°
N07	C15	N05	C16	168.6°	179.7°
N07	C15	N05	C10	22.4°	0.4°
C15	N07	C20	H9	179.8°	180.0°
C15	C17	N06	C16	9.3°	0.0°
C17	C15	N05	C16	11.6°	0.1°
C17	C15	N05	C10	157.5°	180.0°
N06	C17	C15	N05	1.4°	0.1°
C17	N06	C16	N05	21.7°	0.0°
C17	N06	C16	H5	158.3°	180.0°
C15	N05	C10	C11	54.9°	65.2°
C15	N05	C16	N06	22.9°	0.1°
C15	N05	C16	C10	169.4°	179.9°
C15	N05	C10	O01	171.4°	178.6°
C15	N05	C10	C13	68.7°	58.2°
C15	N05	C16	H5	157.1°	180.0°
C12	C11	O02	C10	117.3°	111.6°
C12	C11	O02	H1	121.4°	124.3°
C12	C11	C10	H1	119.4°	117.9°
C11	C12	C14	H2	115.3°	118.6°
C11	C12	C14	C18	145.7°	176.7°
C12	C11	C10	N05	115.5°	83.2°
C11	C12	C14	O01	33.7°	3.3°
C12	C11	C10	O01	2.6°	35.2°
C12	C11	C10	C13	120.7°	153.5°
C12	C11	O02	H13	180.0°	61.4°
C11	C12	O03	H14	180.0°	180.0°
O02	C11	C10	H1	121.9°	124.1°
O02	C11	C12	C14	138.3°	98.3°
O02	C11	C10	N05	125.8°	158.9°
O02	C11	C10	O01	116.1°	82.8°
O02	C11	C10	C13	2.0°	35.5°
O02	C11	C12	H2	23.0°	20.3°
C10	C11	C12	C14	19.7°	19.6°
C11	C10	N05	C16	111.7°	115.0°
C11	C10	N05	O01	116.5°	113.4°
C11	C10	N05	C13	123.6°	123.4°
C11	C10	O01	C14	24.6°	40.0°
C11	C10	O01	C13	117.2°	118.3°
C11	C10	C13	O04	180.0°	179.8°
C10	C11	C12	H2	95.6°	138.2°
C11	C10	C13	H3	60.0°	60.2°
C11	C10	C13	H4	59.9°	59.8°
C10	C11	O02	H13	62.7°	173.0°
C12	C14	C18	O01	179.2°	180.0°
C12	C14	O01	C10	36.8°	27.5°
C14	C12	C11	H1	99.6°	137.5°
C12	C14	C18	H7	179.2°	0.0°
C12	C14	C18	H8	0.8°	180.0°
C14	C12	O03	H14	61.7°	65.4°
N06	C16	N05	H5	180.0°	180.0°
N06	C16	N05	C10	146.5°	179.9°
C18	C14	O01	C10	142.6°	152.5°
C18	C14	C12	H2	98.9°	64.7°
C14	C18	H7	H8	180.0°	179.9°
C16	N05	C10	O01	4.8°	1.6°
C16	N05	C10	C13	124.8°	121.7°
N05	C10	O01	C14	98.8°	78.4°
N05	C10	O01	C13	119.4°	123.3°
N05	C10	C13	O04	52.7°	56.8°
N05	C10	C11	H1	3.9°	34.7°
N05	C10	C13	H3	67.3°	63.2°
N05	C10	C13	H4	172.8°	176.8°
C10	N05	C16	H5	33.5°	0.1°
C14	O01	C10	C13	141.8°	158.3°
O01	C14	C12	H2	81.7°	115.3°
O01	C14	C18	H7	0.0°	180.0°
O01	C14	C18	H8	180.0°	0.0°
O01	C10	C13	O04	65.5°	66.5°
O01	C10	C11	H1	122.0°	153.1°
O01	C10	C13	H3	174.5°	173.6°
O01	C10	C13	H4	54.6°	53.5°
C10	C13	O04	H3	120.0°	120.0°
C10	C13	O04	H4	120.0°	120.0°
C13	C10	C11	H1	119.9°	88.6°
C10	C13	H3	H4	120.0°	120.0°
C10	C13	O04	H15	180.0°	180.0°
O04	C13	H3	H4	119.9°	120.0°
H1	C11	C12	H2	145.1°	103.9°
H1	C11	O02	H13	58.5°	62.9°
H2	C12	O03	H14	57.6°	57.2°
H3	C13	O04	H15	60.0°	60.0°
H4	C13	O04	H15	60.0°	60.0°

Release date:	2025-12-24
Definition date:	2024-12-25
Last modified:	2025-12-19
Release status:	REL
Processing site:	PDBJ
Derived from:	9KPV