Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "30d18680e33a24a3239571e118b2da45",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.596,
"b": 67.536,
"c": 138.752,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [138.760,2.210],
"number_observations": 219213,
"number_observations_unique": 32615,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.274
},
{
"type": "R(meas)",
"value": 0.297
},
{
"type": "R(pim)",
"value": 0.113
},
{
"type": "I/SigI",
"value": 5.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [2.280,2.210],
"number_observations": 19423,
"number_observations_unique": 2774,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.555
},
{
"type": "R(meas)",
"value": 3.840
},
{
"type": "R(pim)",
"value": 1.440
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.292
}
]
},
{
"resolution_limits": [138.760,9.110],
"number_observations": 3082,
"number_observations_unique": 559,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.065
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 30.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.980
}
]
}
]
}