Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "e88910592d8c67fa1c414cdc4b2ee335",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 81.63,
"b": 81.63,
"c": 134.01,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.040,2.160],
"number_observations": 565663,
"number_observations_unique": 28399,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "R(meas)",
"value": 0.122
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 19.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.220,2.160],
"number_observations": 40610,
"number_observations_unique": 2081,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.620
},
{
"type": "R(meas)",
"value": 1.663
},
{
"type": "R(pim)",
"value": 0.375
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.500
},
{
"type": "CC(1/2)",
"value": 0.848
}
]
},
{
"resolution_limits": [39.040,9.660],
"number_observations": 5399,
"number_observations_unique": 379,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 55.700
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 14.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}