Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e590d36bcf1c3619d8ee6bbe2790e894",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 132.983,
"b": 221.339,
"c": 199.353,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [199.350,2.600],
"number_observations": 654205,
"number_observations_unique": 90297,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "R(pim)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 7.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.640,2.600],
"number_observations": 22554,
"number_observations_unique": 4387,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.711
},
{
"type": "R(pim)",
"value": 0.809
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 5.100
},
{
"type": "CC(1/2)",
"value": 0.307
}
]
},
{
"resolution_limits": [199.350,14.240],
"number_observations": 3712,
"number_observations_unique": 623,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 14.600
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
}
]
}