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Summary Geometry Related PDB entries

SUI

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N	CA	sing	1.47Å	1.44Å
N	H2	sing	1.01Å	0.86Å
N	H	sing	1.01Å	1.02Å
CA	CB	sing	1.54Å	1.54Å
CA	C1	sing	1.51Å	1.53Å
CA	HA	sing	1.09Å	0.98Å
CB	CG	sing	1.51Å	1.55Å
CB	HB1	sing	1.09Å	0.97Å
CB	HB2	sing	1.09Å	0.97Å
CG	OD	doub	1.21Å	1.21Å
CG	N2	sing	1.34Å	1.36Å
C1	O1	doub	1.21Å	1.21Å
C1	N2	sing	1.34Å	1.36Å
N2	C2A	sing	1.46Å	1.44Å
C2A	C	sing	1.51Å	1.53Å
C2A	H2A	sing	1.09Å	0.97Å
C2A	H2B	sing	1.09Å	0.97Å
C	O	doub	1.21Å	1.23Å
C	OXT	sing	1.34Å	1.33Å
OXT	HXT	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CA	N	H2	114.0°	106.7°
CA	N	H	123.0°	106.7°
N	CA	CB	111.2°	110.7°
N	CA	C1	113.4°	110.6°
N	CA	HA	109.2°	110.5°
H2	N	H	123.0°	106.7°
CB	CA	C1	104.6°	103.7°
CB	CA	HA	109.2°	110.5°
CA	CB	CG	103.8°	103.5°
CA	CB	HB1	111.0°	110.6°
CA	CB	HB2	111.0°	110.5°
C1	CA	HA	109.2°	110.6°
CA	C1	O1	124.6°	125.6°
CA	C1	N2	108.3°	109.0°
CG	CB	HB1	111.0°	110.7°
CG	CB	HB2	111.1°	110.6°
CB	CG	OD	124.5°	125.4°
CB	CG	N2	108.3°	109.2°
HB1	CB	HB2	109.0°	110.7°
OD	CG	N2	127.3°	125.4°
CG	N2	C1	115.1°	114.5°
CG	N2	C2A	121.8°	122.8°
O1	C1	N2	127.1°	125.3°
C1	N2	C2A	123.1°	122.7°
N2	C2A	C	112.4°	109.5°
N2	C2A	H2A	109.2°	109.5°
N2	C2A	H2B	109.2°	109.5°
C	C2A	H2A	109.1°	109.5°
C	C2A	H2B	109.1°	109.4°
C2A	C	O	121.5°	120.0°
C2A	C	OXT	116.1°	120.0°
H2A	C2A	H2B	107.8°	109.5°
O	C	OXT	122.4°	120.0°
C	OXT	HXT	116.1°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CA	N	H2	H	180.0°	113.8°
N	CA	CB	C1	122.7°	118.6°
N	CA	CB	HA	120.5°	122.8°
N	CA	C1	HA	122.0°	122.8°
N	CA	CB	CG	123.4°	118.5°
N	CA	CB	HB1	117.3°	122.9°
N	CA	CB	HB2	4.0°	0.1°
N	CA	C1	O1	57.7°	61.4°
N	CA	C1	N2	121.9°	118.5°
H2	N	CA	CB	33.6°	64.1°
H2	N	CA	C1	83.9°	50.3°
H2	N	CA	HA	154.1°	173.1°
H	N	CA	CB	146.4°	177.9°
H	N	CA	C1	96.1°	63.6°
H	N	CA	HA	25.9°	59.3°
CB	CA	C1	HA	116.7°	118.5°
CA	CB	CG	HB1	119.3°	118.5°
CA	CB	CG	HB2	119.3°	118.4°
CA	CB	HB1	HB2	122.5°	122.9°
CA	CB	CG	OD	178.3°	179.9°
CA	CB	CG	N2	0.6°	0.1°
CB	CA	C1	O1	179.0°	180.0°
CB	CA	C1	N2	0.6°	0.1°
C1	CA	CB	CG	0.7°	0.1°
C1	CA	CB	HB1	120.0°	118.4°
C1	CA	CB	HB2	118.7°	118.5°
CA	C1	N2	CG	0.2°	0.1°
CA	C1	O1	N2	179.5°	179.9°
CA	C1	N2	C2A	178.5°	180.0°
HA	CA	CB	CG	116.0°	118.7°
HA	CA	CB	HB1	3.3°	0.1°
HA	CA	CB	HB2	124.6°	122.9°
HA	CA	C1	O1	64.3°	61.4°
HA	CA	C1	N2	116.2°	118.7°
CG	CB	HB1	HB2	122.6°	123.0°
CB	CG	OD	N2	178.8°	180.0°
CB	CG	N2	C1	0.3°	0.0°
CB	CG	N2	C2A	179.0°	179.9°
HB1	CB	CG	OD	59.0°	61.5°
HB1	CB	CG	N2	119.9°	118.5°
HB2	CB	CG	OD	62.4°	61.5°
HB2	CB	CG	N2	118.7°	118.5°
OD	CG	N2	C1	178.6°	180.0°
OD	CG	N2	C2A	0.1°	0.0°
CG	N2	C1	O1	179.4°	180.0°
CG	N2	C1	C2A	178.6°	179.9°
CG	N2	C2A	C	81.9°	89.9°
CG	N2	C2A	H2A	39.2°	150.0°
CG	N2	C2A	H2B	156.9°	30.0°
O1	C1	N2	C2A	2.0°	0.1°
C1	N2	C2A	C	99.5°	90.2°
C1	N2	C2A	H2A	139.3°	29.9°
C1	N2	C2A	H2B	21.7°	149.9°
N2	C2A	C	H2A	121.2°	120.1°
N2	C2A	C	H2B	121.3°	119.9°
N2	C2A	H2A	H2B	118.5°	120.0°
N2	C2A	C	O	133.8°	0.1°
N2	C2A	C	OXT	46.8°	180.0°
C	C2A	H2A	H2B	118.4°	119.9°
C2A	C	O	OXT	179.4°	179.9°
C2A	C	OXT	HXT	180.0°	179.9°
H2A	C2A	C	O	12.6°	120.0°
H2A	C2A	C	OXT	167.9°	59.9°
H2B	C2A	C	O	105.0°	120.1°
H2B	C2A	C	OXT	74.5°	60.1°
O	C	OXT	HXT	0.6°	0.0°

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