X2W
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
CA | CB | sing | 1.53Å | 1.54Å | |
CA | C | sing | 1.51Å | 1.53Å | |
CA | N1 | sing | 1.47Å | 1.46Å | |
CB | CG | sing | 1.53Å | 1.53Å | |
C | O | doub | 1.21Å | 1.25Å | |
C | OXT | sing | 1.34Å | 1.25Å | |
C1 | O1 | doub | 1.21Å | 1.22Å | |
C1 | N1 | sing | 1.35Å | 1.32Å | |
C1 | C2 | sing | 1.51Å | 1.39Å | |
P | O3P | sing | 1.61Å | 1.60Å | |
P | O2P | sing | 1.61Å | 1.59Å | |
P | O1P | doub | 1.48Å | 1.46Å | |
P | OE2 | sing | 1.61Å | 1.61Å | |
C3 | O2 | doub | 1.21Å | 1.23Å | |
C3 | CG | sing | 1.51Å | 1.54Å | |
C3 | OE2 | sing | 1.34Å | 1.36Å | |
CA | HA | sing | 1.09Å | 1.10Å | |
CB | HB1C | sing | 1.09Å | 1.10Å | |
CB | HB2C | sing | 1.09Å | 1.10Å | |
N1 | H1 | sing | 0.97Å | 1.00Å | |
CG | HG1C | sing | 1.09Å | 1.10Å | |
CG | HG2C | sing | 1.09Å | 1.10Å | |
OXT | HXT | sing | 0.97Å | 0.95Å | |
C2 | H21C | sing | 1.09Å | 1.10Å | |
C2 | H22C | sing | 1.09Å | 1.10Å | |
C2 | H23C | sing | 1.09Å | 1.10Å | |
O3P | H3P | sing | 0.97Å | 0.95Å | |
O2P | H2P | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
CB | CA | C | 111.3° | 109.5° |
CB | CA | N1 | 109.0° | 109.5° |
CA | CB | CG | 112.5° | 109.5° |
CB | CA | HA | 108.3° | 109.5° |
CA | CB | HB1C | 108.5° | 109.5° |
CA | CB | HB2C | 107.8° | 109.4° |
C | CA | N1 | 108.8° | 109.4° |
CA | C | O | 116.8° | 120.0° |
CA | C | OXT | 117.5° | 120.0° |
C | CA | HA | 108.6° | 109.5° |
CA | N1 | C1 | 121.9° | 120.0° |
N1 | CA | HA | 110.9° | 109.5° |
CA | N1 | H1 | 119.0° | 120.0° |
CB | CG | C3 | 112.7° | 109.5° |
CG | CB | HB1C | 108.5° | 109.4° |
CG | CB | HB2C | 107.8° | 109.5° |
CB | CG | HG1C | 108.4° | 109.5° |
CB | CG | HG2C | 107.7° | 109.5° |
O | C | OXT | 125.6° | 120.0° |
C | OXT | HXT | 109.5° | 117.0° |
O1 | C1 | N1 | 122.6° | 120.0° |
O1 | C1 | C2 | 118.8° | 120.0° |
N1 | C1 | C2 | 118.7° | 120.0° |
C1 | N1 | H1 | 119.0° | 120.0° |
C1 | C2 | H21C | 109.5° | 109.5° |
C1 | C2 | H22C | 109.5° | 109.5° |
C1 | C2 | H23C | 109.5° | 109.5° |
O3P | P | O2P | 103.7° | 109.5° |
O3P | P | O1P | 113.2° | 109.5° |
O3P | P | OE2 | 105.0° | 109.5° |
P | O3P | H3P | 109.5° | 114.0° |
O2P | P | O1P | 114.0° | 109.5° |
O2P | P | OE2 | 104.4° | 109.4° |
P | O2P | H2P | 109.5° | 114.0° |
O1P | P | OE2 | 115.4° | 109.5° |
P | OE2 | C3 | 114.3° | 117.0° |
O2 | C3 | CG | 121.7° | 120.0° |
O2 | C3 | OE2 | 123.7° | 120.0° |
CG | C3 | OE2 | 114.5° | 120.0° |
C3 | CG | HG1C | 108.4° | 109.5° |
C3 | CG | HG2C | 107.6° | 109.5° |
HB1C | CB | HB2C | 111.9° | 109.5° |
HG1C | CG | HG2C | 112.1° | 109.4° |
H21C | C2 | H22C | 109.5° | 109.5° |
H21C | C2 | H23C | 109.5° | 109.4° |
H22C | C2 | H23C | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
CB | CA | C | N1 | 120.2° | 120.0° |
CB | CA | C | HA | 119.1° | 120.0° |
CB | CA | N1 | HA | 119.1° | 120.0° |
CA | CB | CG | HB1C | 120.0° | 120.0° |
CA | CB | CG | HB2C | 118.7° | 120.0° |
CB | CA | C | O | 99.8° | 120.0° |
CB | CA | C | OXT | 81.5° | 60.0° |
CB | CA | N1 | C1 | 162.1° | 155.0° |
CA | CB | CG | C3 | 59.8° | 180.0° |
CA | CB | HB1C | HB2C | 118.7° | 120.0° |
CB | CA | N1 | H1 | 17.9° | 25.0° |
CA | CB | CG | HG1C | 179.8° | 60.0° |
CA | CB | CG | HG2C | 58.7° | 60.0° |
C | CA | N1 | HA | 119.3° | 120.0° |
C | CA | CB | CG | 70.3° | 175.0° |
CA | C | O | OXT | 178.6° | 180.0° |
C | CA | N1 | C1 | 76.3° | 85.0° |
C | CA | CB | HB1C | 169.8° | 65.0° |
C | CA | CB | HB2C | 48.4° | 55.0° |
C | CA | N1 | H1 | 103.7° | 95.0° |
CA | C | OXT | HXT | 178.6° | 180.0° |
N1 | CA | CB | CG | 169.7° | 65.0° |
N1 | CA | C | O | 140.0° | 0.0° |
N1 | CA | C | OXT | 38.7° | 180.0° |
CA | N1 | C1 | O1 | 1.1° | 0.0° |
CA | N1 | C1 | H1 | 180.0° | 180.0° |
CA | N1 | C1 | C2 | 179.4° | 180.0° |
N1 | CA | CB | HB1C | 49.8° | 55.0° |
N1 | CA | CB | HB2C | 71.6° | 175.0° |
CB | CG | C3 | O2 | 31.5° | 0.0° |
CB | CG | C3 | HG1C | 120.0° | 120.0° |
CB | CG | C3 | HG2C | 118.6° | 120.0° |
CB | CG | C3 | OE2 | 145.8° | 180.0° |
CG | CB | CA | HA | 49.0° | 55.0° |
CG | CB | HB1C | HB2C | 118.8° | 120.0° |
CB | CG | HG1C | HG2C | 118.7° | 120.0° |
O | C | CA | HA | 19.3° | 120.0° |
O | C | OXT | HXT | 0.0° | 0.1° |
OXT | C | CA | HA | 159.4° | 60.0° |
O1 | C1 | N1 | C2 | 179.5° | 180.0° |
O1 | C1 | N1 | H1 | 178.9° | 180.0° |
O1 | C1 | C2 | H21C | 72.1° | 90.0° |
O1 | C1 | C2 | H22C | 47.9° | 150.0° |
O1 | C1 | C2 | H23C | 167.9° | 30.0° |
C1 | N1 | CA | HA | 43.0° | 35.0° |
N1 | C1 | C2 | H21C | 107.5° | 90.1° |
N1 | C1 | C2 | H22C | 132.5° | 30.0° |
N1 | C1 | C2 | H23C | 12.5° | 150.0° |
C2 | C1 | N1 | H1 | 0.6° | 0.0° |
C1 | C2 | H21C | H22C | 120.0° | 120.0° |
C1 | C2 | H21C | H23C | 120.0° | 120.0° |
C1 | C2 | H22C | H23C | 120.0° | 120.0° |
O3P | P | O2P | O1P | 123.5° | 120.0° |
O3P | P | O2P | OE2 | 109.7° | 120.0° |
O3P | P | O1P | OE2 | 121.0° | 120.0° |
O3P | P | OE2 | C3 | 141.8° | 65.0° |
O3P | P | O2P | H2P | 132.4° | 60.0° |
O2P | P | O1P | OE2 | 120.8° | 120.0° |
O2P | P | OE2 | C3 | 109.4° | 175.0° |
O2P | P | O3P | H3P | 73.5° | 60.1° |
O1P | P | OE2 | C3 | 16.5° | 55.0° |
O1P | P | O3P | H3P | 50.5° | 179.9° |
O1P | P | O2P | H2P | 104.1° | 60.0° |
P | OE2 | C3 | O2 | 77.6° | 0.0° |
P | OE2 | C3 | CG | 105.2° | 180.0° |
OE2 | P | O3P | H3P | 177.2° | 59.9° |
OE2 | P | O2P | H2P | 22.6° | 180.0° |
O2 | C3 | CG | OE2 | 177.3° | 180.0° |
O2 | C3 | CG | HG1C | 88.5° | 120.0° |
O2 | C3 | CG | HG2C | 150.1° | 120.0° |
C3 | CG | CB | HB1C | 60.1° | 60.0° |
C3 | CG | CB | HB2C | 178.5° | 60.0° |
C3 | CG | HG1C | HG2C | 118.7° | 120.0° |
OE2 | C3 | CG | HG1C | 94.2° | 60.0° |
OE2 | C3 | CG | HG2C | 27.2° | 60.0° |
HA | CA | CB | HB1C | 71.0° | 175.0° |
HA | CA | CB | HB2C | 167.7° | 65.0° |
HA | CA | N1 | H1 | 137.0° | 145.0° |
HB1C | CB | CG | HG1C | 59.8° | 180.0° |
HB1C | CB | CG | HG2C | 178.7° | 60.0° |
HB2C | CB | CG | HG1C | 61.5° | 60.0° |
HB2C | CB | CG | HG2C | 59.9° | 180.0° |
H21C | C2 | H22C | H23C | 120.0° | 120.0° |