Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "95ba4468a0d336ffec89fe9a07ba49f1",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 30.806,
"b": 81.516,
"c": 32.170,
"alpha": 90.00,
"beta": 117.94,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.758,1.250],
"number_observations": 119038,
"number_observations_unique": 36505,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 11.0
},
{
"type": "Completeness",
"value": 94.300
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
"refln_shells": [
{
"resolution_limits": [1.254,1.250],
"number_observations": 1088,
"number_observations_unique": 350,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.372
},
{
"type": "Completeness",
"value": 89.700
},
{
"type": "Redundancy",
"value": 3.100
}
]
},
{
"resolution_limits": [40.758,5.797],
"number_observations": 1176,
"number_observations_unique": 401,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 2.900
}
]
}
]
}