Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ad1f889fbc7e02abb0eae139ce9549c9",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.15,
"b": 45.66,
"c": 78.88,
"alpha": 90.00,
"beta": 126.88,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.150,1.870],
"number_observations": 84657,
"number_observations_unique": 26217,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "R(meas)",
"value": 0.131
},
{
"type": "R(pim)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 9.700
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.978
}
]
},
"refln_shells": [
{
"resolution_limits": [1.920,1.870],
"number_observations_unique": 1963,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.86
},
{
"type": "R(meas)",
"value": 1.03
},
{
"type": "R(pim)",
"value": 0.569
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.392
}
]
},
{
"resolution_limits": [39.150,8.360],
"number_observations_unique": 274,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "Completeness",
"value": 80.200
},
{
"type": "Redundancy",
"value": 2.900
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}