Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "94fb90fbff1632b54e97d8dddebfdd24",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 84.125,
"b": 153.433,
"c": 141.314,
"alpha": 90.00,
"beta": 92.44,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.366],
"number_observations_unique": 139487,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.103
},
{
"type": "R(pim)",
"value": 0.089
},
{
"type": "I/SigI",
"value": 14.2
},
{
"type": "Completeness",
"value": 96.3
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.41,2.366],
"number_observations_unique": 6996,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.58
},
{
"type": "R(meas)",
"value": 0.809
},
{
"type": "R(pim)",
"value": 0.418
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.729
}
]
}
]
}