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Summary Geometry Related PDB entries

WQ7

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C6	C5	doub	1.36Å	1.35Å
C6	C7	sing	1.41Å	1.43Å
C5	C4	sing	1.40Å	1.40Å
O1	C7	doub	1.22Å	1.24Å
C7	N2	sing	1.35Å	1.41Å
C4	C3	doub	1.35Å	1.34Å
N2	C3	sing	1.36Å	1.36Å
N2	C2	sing	1.47Å	1.48Å
C2	C1	sing	1.53Å	1.52Å
C1	N1	sing	1.47Å	1.47Å
N1	H1	sing	1.01Å	1.00Å
N1	H2	sing	1.01Å	1.00Å
C4	H4	sing	1.08Å	1.08Å
C5	H5	sing	1.08Å	1.08Å
C6	H6	sing	1.08Å	1.08Å
C1	H7	sing	1.09Å	1.10Å
C1	H8	sing	1.09Å	1.10Å
C2	H9	sing	1.09Å	1.10Å
C2	H10	sing	1.09Å	1.10Å
C3	H11	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C5	C6	C7	121.2°	119.3°
C6	C5	C4	120.3°	119.3°
C6	C5	H5	119.9°	120.4°
C5	C6	H6	119.4°	120.4°
C6	C7	O1	124.7°	120.0°
C6	C7	N2	115.9°	120.0°
C7	C6	H6	119.4°	120.4°
C5	C4	C3	119.8°	119.9°
C5	C4	H4	120.1°	120.0°
C4	C5	H5	119.8°	120.4°
O1	C7	N2	119.4°	120.0°
C7	N2	C3	121.9°	120.8°
C7	N2	C2	117.6°	119.6°
C4	C3	N2	120.9°	120.7°
C3	C4	H4	120.1°	120.0°
C4	C3	H11	119.6°	119.6°
C3	N2	C2	120.5°	119.6°
N2	C3	H11	119.5°	119.7°
N2	C2	C1	112.5°	109.5°
N2	C2	H9	108.7°	109.5°
N2	C2	H10	108.7°	109.4°
C2	C1	N1	110.0°	109.5°
C2	C1	H7	109.3°	109.5°
C2	C1	H8	109.3°	109.5°
C1	C2	H9	108.7°	109.5°
C1	C2	H10	108.7°	109.5°
C1	N1	H1	109.5°	111.0°
C1	N1	H2	109.4°	111.0°
N1	C1	H7	109.3°	109.5°
N1	C1	H8	109.3°	109.4°
H1	N1	H2	109.4°	111.0°
H7	C1	H8	109.5°	109.5°
H9	C2	H10	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C5	C6	C7	H6	180.0°	179.9°
C6	C5	C4	H5	180.0°	180.0°
C5	C6	C7	O1	179.1°	180.0°
C5	C6	C7	N2	1.0°	0.0°
C6	C5	C4	C3	0.0°	0.0°
C6	C5	C4	H4	180.0°	179.7°
C7	C6	C5	C4	1.5°	0.0°
C6	C7	O1	N2	179.9°	180.0°
C6	C7	N2	C3	1.0°	0.0°
C6	C7	N2	C2	179.1°	180.0°
C7	C6	C5	H5	178.5°	180.0°
C5	C4	C3	H4	180.0°	179.7°
C5	C4	C3	N2	1.9°	0.0°
C4	C5	C6	H6	178.5°	179.9°
C5	C4	C3	H11	178.1°	179.8°
O1	C7	N2	C3	178.9°	180.0°
O1	C7	N2	C2	0.8°	0.0°
O1	C7	C6	H6	0.9°	0.1°
C7	N2	C3	C4	2.5°	0.1°
C7	N2	C3	C2	178.1°	179.9°
C7	N2	C2	C1	81.5°	90.0°
N2	C7	C6	H6	179.0°	179.9°
C7	N2	C2	H9	39.0°	30.0°
C7	N2	C2	H10	158.1°	150.0°
C7	N2	C3	H11	177.5°	179.8°
C4	C3	N2	H11	180.0°	179.8°
C4	C3	N2	C2	179.5°	180.0°
C3	C4	C5	H5	179.9°	180.0°
C3	N2	C2	C1	96.7°	89.9°
N2	C3	C4	H4	178.1°	179.7°
C3	N2	C2	H9	142.9°	150.0°
C3	N2	C2	H10	23.8°	30.0°
N2	C2	C1	H9	120.4°	120.0°
N2	C2	C1	H10	120.5°	120.0°
N2	C2	C1	N1	176.7°	180.0°
N2	C2	C1	H7	63.2°	60.0°
N2	C2	C1	H8	56.6°	60.0°
N2	C2	H9	H10	118.6°	120.0°
C2	N2	C3	H11	0.6°	0.2°
C2	C1	N1	H7	120.1°	120.0°
C2	C1	N1	H8	120.1°	120.0°
C2	C1	N1	H1	180.0°	180.0°
C2	C1	N1	H2	60.0°	56.1°
C2	C1	H7	H8	119.7°	120.0°
C1	C2	H9	H10	118.6°	120.0°
C1	N1	H1	H2	120.0°	123.8°
N1	C1	H7	H8	119.8°	120.0°
N1	C1	C2	H9	56.3°	60.0°
N1	C1	C2	H10	62.8°	60.1°
H1	N1	C1	H7	60.0°	59.9°
H1	N1	C1	H8	59.9°	60.1°
H2	N1	C1	H7	179.9°	63.9°
H2	N1	C1	H8	60.1°	176.1°
H4	C4	C5	H5	0.1°	0.3°
H4	C4	C3	H11	1.9°	0.1°
H5	C5	C6	H6	1.5°	0.1°
H7	C1	C2	H9	176.4°	180.0°
H7	C1	C2	H10	57.3°	59.9°
H8	C1	C2	H9	63.8°	59.9°
H8	C1	C2	H10	177.1°	180.0°

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