Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ff0ed82b4c5f759bcc5329a17901e923",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 37.05,
"b": 40.24,
"c": 110.94,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.87000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [26.170,1.600],
"number_observations": 96255,
"number_observations_unique": 22384,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(meas)",
"value": 0.064
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 16.300
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 4.300
}
]
},
"refln_shells": [
{
"resolution_limits": [1.640,1.600],
"number_observations_unique": 1627,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.539
},
{
"type": "R(meas)",
"value": 0.682
},
{
"type": "R(pim)",
"value": 0.317
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 4.300
}
]
},
{
"resolution_limits": [26.170,7.160],
"number_observations_unique": 278,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.023
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 46.900
},
{
"type": "Completeness",
"value": 93.200
},
{
"type": "Redundancy",
"value": 3.900
}
]
}
]
}