Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "af6756584f0d8e0d4bdd501b5494e527",
"space_group_name": "P 3 2 1",
"unit_cell": {
"a": 73.975,
"b": 73.975,
"c": 174.328,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91841],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.040,1.910],
"number_observations": 237608,
"number_observations_unique": 43960,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 14.100
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.950,1.910],
"number_observations": 14046,
"number_observations_unique": 2752,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.761
},
{
"type": "R(pim)",
"value": 0.368
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 94.000
},
{
"type": "Redundancy",
"value": 5.100
},
{
"type": "CC(1/2)",
"value": 0.652
}
]
},
{
"resolution_limits": [43.040,8.940],
"number_observations": 2261,
"number_observations_unique": 507,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 49.400
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 4.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}