4WQ

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CM3	CZ	sing	1.53Å	1.54Å
CZ	CM1	sing	1.53Å	1.53Å
CZ	CM2	sing	1.53Å	1.53Å
CZ	CE	sing	1.53Å	1.53Å
CD	CE	sing	1.53Å	1.53Å
CD	CG	sing	1.53Å	1.53Å
CG	CB	sing	1.53Å	1.52Å
CB	CA	sing	1.53Å	1.53Å
CA	N	sing	1.47Å	1.46Å
CA	C	sing	1.51Å	1.52Å
C	O	doub	1.21Å	1.22Å
N	H	sing	1.01Å	1.00Å
N	H2	sing	1.01Å	1.00Å
CA	HA	sing	1.09Å	1.10Å
CB	H5	sing	1.09Å	1.10Å
CB	H6	sing	1.09Å	1.10Å
CG	H7	sing	1.09Å	1.10Å
CG	H8	sing	1.09Å	1.10Å
CD	H9	sing	1.09Å	1.10Å
CD	H10	sing	1.09Å	1.10Å
CE	H11	sing	1.09Å	1.10Å
CE	H12	sing	1.09Å	1.10Å
CM3	H13	sing	1.09Å	1.10Å
CM3	H14	sing	1.09Å	1.10Å
CM3	H15	sing	1.09Å	1.10Å
CM2	H16	sing	1.09Å	1.10Å
CM2	H17	sing	1.09Å	1.10Å
CM2	H18	sing	1.09Å	1.10Å
CM1	H19	sing	1.09Å	1.10Å
CM1	H20	sing	1.09Å	1.10Å
CM1	H21	sing	1.09Å	1.10Å
C	OXT	sing	1.34Å	73.10Å
OXT	HXT	sing	0.97Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CM3	CZ	CM1	108.2°	109.4°
CM3	CZ	CM2	109.4°	109.4°
CM3	CZ	CE	111.2°	109.4°
CZ	CM3	H13	109.5°	109.4°
CZ	CM3	H14	109.5°	109.5°
CZ	CM3	H15	109.5°	109.5°
CM1	CZ	CM2	109.8°	109.5°
CM1	CZ	CE	109.8°	109.5°
CZ	CM1	H19	109.5°	109.4°
CZ	CM1	H20	109.4°	109.5°
CZ	CM1	H21	109.5°	109.5°
CM2	CZ	CE	108.5°	109.5°
CZ	CM2	H16	109.5°	109.5°
CZ	CM2	H17	109.5°	109.5°
CZ	CM2	H18	109.4°	109.5°
CZ	CE	CD	116.3°	109.4°
CZ	CE	H11	107.8°	109.5°
CZ	CE	H12	107.7°	109.5°
CE	CD	CG	112.7°	109.5°
CE	CD	H9	108.7°	109.5°
CE	CD	H10	108.7°	109.5°
CD	CE	H11	107.7°	109.4°
CD	CE	H12	107.8°	109.4°
CD	CG	CB	109.8°	109.5°
CD	CG	H7	109.4°	109.4°
CD	CG	H8	109.4°	109.4°
CG	CD	H9	108.7°	109.5°
CG	CD	H10	108.6°	109.4°
CG	CB	CA	115.5°	109.5°
CG	CB	H5	107.9°	109.5°
CG	CB	H6	107.9°	109.5°
CB	CG	H7	109.4°	109.5°
CB	CG	H8	109.4°	109.5°
CB	CA	N	107.6°	109.5°
CB	CA	C	113.8°	109.5°
CB	CA	HA	108.7°	109.4°
CA	CB	H5	107.9°	109.4°
CA	CB	H6	107.9°	109.4°
N	CA	C	108.3°	109.5°
CA	N	H	109.5°	110.9°
CA	N	H2	109.5°	111.0°
N	CA	HA	109.6°	109.4°
CA	C	O	117.8°	120.0°
C	CA	HA	108.8°	109.5°
CA	C	OXT	42.1°	120.0°
O	C	OXT	86.0°	120.0°
H	N	H2	109.4°	111.0°
H5	CB	H6	109.5°	109.4°
H7	CG	H8	109.5°	109.5°
H9	CD	H10	109.5°	109.4°
H11	CE	H12	109.5°	109.5°
H13	CM3	H14	109.4°	109.5°
H13	CM3	H15	109.5°	109.5°
H14	CM3	H15	109.5°	109.5°
H16	CM2	H17	109.5°	109.4°
H16	CM2	H18	109.5°	109.5°
H17	CM2	H18	109.5°	109.5°
H19	CM1	H20	109.5°	109.4°
H19	CM1	H21	109.5°	109.4°
H20	CM1	H21	109.5°	109.5°
C	OXT	HXT	90.0°	117.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CM3	CZ	CM1	CM2	119.3°	120.0°
CM3	CZ	CM1	CE	121.5°	120.0°
CM3	CZ	CM2	CE	121.5°	120.0°
CM3	CZ	CE	CD	58.5°	180.0°
CM3	CZ	CE	H11	179.5°	60.1°
CM3	CZ	CE	H12	62.4°	60.0°
CZ	CM3	H13	H14	120.0°	120.0°
CZ	CM3	H13	H15	120.0°	120.0°
CZ	CM3	H14	H15	120.0°	120.0°
CM3	CZ	CM2	H16	180.0°	60.0°
CM3	CZ	CM2	H17	60.0°	60.0°
CM3	CZ	CM2	H18	60.0°	180.0°
CM3	CZ	CM1	H19	180.0°	180.0°
CM3	CZ	CM1	H20	60.0°	60.1°
CM3	CZ	CM1	H21	60.0°	60.0°
CM1	CZ	CM2	CE	120.0°	120.1°
CM1	CZ	CE	CD	61.1°	60.1°
CM1	CZ	CE	H11	59.9°	59.9°
CM1	CZ	CE	H12	177.9°	180.0°
CM1	CZ	CM3	H13	180.0°	60.0°
CM1	CZ	CM3	H14	60.0°	180.0°
CM1	CZ	CM3	H15	60.0°	60.0°
CM1	CZ	CM2	H16	61.5°	60.0°
CM1	CZ	CM2	H17	58.5°	179.9°
CM1	CZ	CM2	H18	178.5°	60.0°
CZ	CM1	H19	H20	120.0°	120.0°
CZ	CM1	H19	H21	120.0°	120.0°
CZ	CM1	H20	H21	120.0°	120.1°
CM2	CZ	CE	CD	178.9°	60.0°
CM2	CZ	CE	H11	60.1°	180.0°
CM2	CZ	CE	H12	57.9°	59.9°
CM2	CZ	CM3	H13	60.4°	180.0°
CM2	CZ	CM3	H14	59.5°	60.0°
CM2	CZ	CM3	H15	179.5°	60.0°
CZ	CM2	H16	H17	120.0°	120.0°
CZ	CM2	H16	H18	120.0°	120.0°
CZ	CM2	H17	H18	120.0°	120.0°
CM2	CZ	CM1	H19	60.7°	60.0°
CM2	CZ	CM1	H20	179.3°	180.0°
CM2	CZ	CM1	H21	59.3°	59.9°
CZ	CE	CD	H11	121.0°	120.0°
CZ	CE	CD	H12	121.0°	120.0°
CZ	CE	CD	CG	166.6°	180.0°
CZ	CE	CD	H9	72.9°	60.0°
CZ	CE	CD	H10	46.2°	60.0°
CZ	CE	H11	H12	116.9°	120.1°
CE	CZ	CM3	H13	59.4°	60.0°
CE	CZ	CM3	H14	179.4°	60.0°
CE	CZ	CM3	H15	60.6°	180.0°
CE	CZ	CM2	H16	58.5°	179.9°
CE	CZ	CM2	H17	178.5°	60.0°
CE	CZ	CM2	H18	61.5°	60.0°
CE	CZ	CM1	H19	58.5°	60.0°
CE	CZ	CM1	H20	61.5°	59.9°
CE	CZ	CM1	H21	178.5°	180.0°
CE	CD	CG	H9	120.5°	120.1°
CE	CD	CG	H10	120.5°	120.0°
CE	CD	CG	CB	61.5°	180.0°
CE	CD	CG	H7	178.5°	60.0°
CE	CD	CG	H8	58.6°	60.0°
CE	CD	H9	H10	118.5°	120.0°
CD	CE	H11	H12	116.9°	120.0°
CD	CG	CB	H7	120.0°	120.0°
CD	CG	CB	H8	120.1°	120.0°
CD	CG	CB	CA	170.4°	180.0°
CD	CG	CB	H5	68.8°	60.0°
CD	CG	CB	H6	49.5°	60.0°
CD	CG	H7	H8	119.9°	119.9°
CG	CD	H9	H10	118.5°	119.9°
CG	CD	CE	H11	45.6°	60.0°
CG	CD	CE	H12	72.4°	60.0°
CG	CB	CA	H5	120.9°	120.0°
CG	CB	CA	H6	120.9°	120.0°
CG	CB	CA	N	174.5°	65.0°
CG	CB	CA	C	54.5°	175.0°
CG	CB	CA	HA	66.9°	55.0°
CG	CB	H5	H6	117.3°	120.0°
CB	CG	H7	H8	119.9°	120.0°
CB	CG	CD	H9	59.0°	59.9°
CB	CG	CD	H10	178.1°	60.0°
CB	CA	N	C	123.4°	120.0°
CB	CA	N	HA	118.0°	119.9°
CB	CA	C	HA	121.3°	120.0°
CB	CA	C	O	75.7°	100.0°
CB	CA	N	H	180.0°	60.0°
CB	CA	N	H2	60.0°	63.8°
CA	CB	H5	H6	117.2°	119.9°
CA	CB	CG	H7	50.4°	60.0°
CA	CB	CG	H8	69.5°	60.0°
CB	CA	C	OXT	30.2°	80.0°
N	CA	C	HA	119.0°	120.0°
N	CA	C	O	44.0°	20.0°
CA	N	H	H2	120.0°	123.9°
N	CA	CB	H5	53.6°	55.1°
N	CA	CB	H6	64.6°	175.0°
N	CA	C	OXT	89.5°	160.0°
CA	C	O	OXT	28.6°	180.0°
C	CA	N	H	56.6°	60.0°
C	CA	N	H2	63.4°	176.1°
C	CA	CB	H5	66.4°	65.0°
C	CA	CB	H6	175.4°	55.0°
CA	C	OXT	HXT	90.0°	180.0°
O	C	CA	HA	163.0°	140.0°
O	C	OXT	HXT	90.0°	0.0°
H	N	CA	HA	62.0°	179.9°
H2	N	CA	HA	178.0°	56.1°
HA	CA	CB	H5	172.2°	175.0°
HA	CA	CB	H6	54.0°	65.1°
HA	CA	C	OXT	151.5°	40.0°
H5	CB	CG	H7	171.2°	180.0°
H5	CB	CG	H8	51.3°	60.0°
H6	CB	CG	H7	70.5°	60.0°
H6	CB	CG	H8	169.6°	180.0°
H7	CG	CD	H9	61.0°	179.9°
H7	CG	CD	H10	58.0°	60.0°
H8	CG	CD	H9	179.1°	60.1°
H8	CG	CD	H10	61.9°	180.0°
H9	CD	CE	H11	166.1°	180.0°
H9	CD	CE	H12	48.1°	60.0°
H10	CD	CE	H11	74.8°	60.0°
H10	CD	CE	H12	167.1°	180.0°
H13	CM3	H14	H15	120.0°	120.1°
H16	CM2	H17	H18	120.0°	120.0°
H19	CM1	H20	H21	120.0°	120.0°

Release date:	2015-07-01
Definition date:	2015-06-12
Last modified:	2024-09-27
Release status:	REL
Processing site:	RCSB
Derived from:	5C0M