Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "492c86ae7128dc039afe3c01ce0eb43d",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 58.19,
"b": 159.13,
"c": 174.99,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [87.495,1.940],
"number_observations_unique": 112254,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "R(meas)",
"value": 0.119
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 11.3
},
{
"type": "Completeness",
"value": 92.8
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.974,1.940],
"number_observations_unique": 4257,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.839
},
{
"type": "R(meas)",
"value": 1.003
},
{
"type": "R(pim)",
"value": 0.541
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 72.2
},
{
"type": "Redundancy",
"value": 5.7
},
{
"type": "CC(1/2)",
"value": 0.801
}
]
}
]
}