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Summary Geometry Related PDB entries

4Z3

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C09	C08	doub	1.38Å	1.54Å	Aromatic
C09	C10	sing	1.38Å	1.55Å	Aromatic
C08	C07	sing	1.39Å	1.54Å	Aromatic
C10	C11	doub	1.38Å	1.55Å	Aromatic
O01	N02	sing	1.42Å	1.39Å
C07	N06	sing	1.40Å	1.47Å
C07	C12	doub	1.39Å	1.57Å	Aromatic
N06	C04	sing	1.35Å	1.47Å
N02	C03	doub	1.29Å	1.26Å
C11	C12	sing	1.38Å	1.54Å	Aromatic
C12	BR13	sing	1.89Å	1.96Å
C04	C03	sing	1.48Å	1.54Å
C04	O05	doub	1.22Å	1.18Å
C10	H1	sing	1.08Å	1.08Å
O01	H2	sing	0.97Å	0.95Å
C03	H4	sing	1.08Å	1.08Å
N06	H6	sing	0.97Å	1.00Å
C08	H7	sing	1.08Å	1.08Å
C09	H8	sing	1.08Å	1.08Å
C11	H9	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C08	C09	C10	120.1°	120.0°
C09	C08	C07	120.9°	120.0°
C09	C08	H7	119.5°	120.0°
C08	C09	H8	120.0°	120.0°
C09	C10	C11	119.4°	120.1°
C09	C10	H1	120.3°	119.9°
C10	C09	H8	120.0°	120.0°
C08	C07	N06	119.4°	120.1°
C08	C07	C12	119.2°	119.9°
C07	C08	H7	119.5°	120.1°
C10	C11	C12	120.7°	120.1°
C11	C10	H1	120.3°	120.0°
C10	C11	H9	119.6°	119.9°
O01	N02	C03	120.9°	119.9°
N02	O01	H2	109.5°	114.0°
N06	C07	C12	121.4°	120.0°
C07	N06	C04	122.9°	120.0°
C07	N06	H6	118.6°	120.0°
C07	C12	C11	119.7°	119.9°
C07	C12	BR13	121.1°	120.1°
N06	C04	C03	120.5°	120.0°
N06	C04	O05	119.6°	120.0°
C04	N06	H6	118.5°	120.0°
N02	C03	C04	119.9°	120.0°
N02	C03	H4	120.1°	120.0°
C11	C12	BR13	119.2°	120.1°
C12	C11	H9	119.6°	120.0°
C03	C04	O05	119.4°	120.0°
C04	C03	H4	120.0°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C08	C09	C10	H8	180.0°	180.0°
C09	C08	C07	H7	180.0°	179.7°
C08	C09	C10	C11	0.1°	0.0°
C09	C08	C07	N06	178.0°	179.8°
C09	C08	C07	C12	0.6°	0.7°
C08	C09	C10	H1	180.0°	179.8°
C10	C09	C08	C07	0.2°	0.5°
C09	C10	C11	H1	180.0°	179.8°
C09	C10	C11	C12	0.2°	0.3°
C10	C09	C08	H7	179.7°	179.7°
C09	C10	C11	H9	179.8°	179.8°
C08	C07	N06	C12	177.4°	179.5°
C08	C07	N06	C04	136.9°	34.7°
C08	C07	C12	C11	0.7°	0.5°
C08	C07	C12	BR13	178.7°	180.0°
C08	C07	N06	H6	43.1°	145.2°
C07	C08	C09	H8	179.8°	179.5°
C10	C11	C12	C07	0.5°	0.0°
C10	C11	C12	H9	180.0°	180.0°
C10	C11	C12	BR13	178.9°	179.5°
C11	C10	C09	H8	180.0°	180.0°
O01	N02	C03	C04	121.1°	180.0°
O01	N02	C03	H4	58.8°	0.0°
C07	N06	C04	H6	180.0°	179.9°
N06	C07	C12	C11	178.1°	179.9°
N06	C07	C12	BR13	1.3°	0.5°
C07	N06	C04	C03	165.9°	175.5°
C07	N06	C04	O05	21.9°	4.5°
N06	C07	C08	H7	2.0°	0.0°
C12	C07	N06	C04	45.7°	144.8°
C07	C12	C11	BR13	179.4°	179.5°
C12	C07	N06	H6	134.3°	35.3°
C12	C07	C08	H7	179.4°	179.5°
C07	C12	C11	H9	179.5°	180.0°
N06	C04	C03	N02	7.4°	180.0°
N06	C04	C03	O05	172.2°	180.0°
N06	C04	C03	H4	172.6°	0.0°
N02	C03	C04	H4	180.0°	180.0°
N02	C03	C04	O05	164.8°	0.0°
C03	N02	O01	H2	180.0°	180.0°
C12	C11	C10	H1	179.8°	179.9°
BR13	C12	C11	H9	1.1°	0.5°
C03	C04	N06	H6	14.1°	4.6°
O05	C04	C03	H4	15.1°	180.0°
O05	C04	N06	H6	158.1°	175.4°
H1	C10	C09	H8	0.0°	0.2°
H1	C10	C11	H9	0.2°	0.0°
H7	C08	C09	H8	0.2°	0.2°

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