Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "6245cc778c4cfe5818687e316f89f54c",
"space_group_name": "P 1",
"unit_cell": {
"a": 91.868,
"b": 92.080,
"c": 168.811,
"alpha": 83.000,
"beta": 77.938,
"gamma": 60.100
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [82.52,1.95],
"number_observations_unique": 310143,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.132
},
{
"type": "R(meas)",
"value": 0.186
},
{
"type": "R(pim)",
"value": 0.132
},
{
"type": "I/SigI",
"value": 5.0
},
{
"type": "Completeness",
"value": 90.7
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
"refln_shells": [
{
"resolution_limits": [82.52,10.68],
"number_observations_unique": 2031,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.064
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
{
"resolution_limits": [1.98,1.95],
"number_observations_unique": 14508,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.204
},
{
"type": "R(meas)",
"value": 1.702
},
{
"type": "R(pim)",
"value": 1.204
},
{
"type": "Redundancy",
"value": 3.9
},
{
"type": "CC(1/2)",
"value": 0.392
}
]
}
]
}