Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "702a955314ab85f2426b5ac23aa253c9",
"space_group_name": "H 3 2",
"unit_cell": {
"a": 42.874,
"b": 42.874,
"c": 232.245,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.710,2.100],
"number_observations": 23796,
"number_observations_unique": 5037,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 13.700
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.160,2.100],
"number_observations": 1453,
"number_observations_unique": 361,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.495
},
{
"type": "R(pim)",
"value": 0.247
},
{
"type": "I/SigI",
"value": 3.200
},
{
"type": "Completeness",
"value": 88.600
},
{
"type": "Redundancy",
"value": 4.000
},
{
"type": "CC(1/2)",
"value": 0.833
}
]
},
{
"resolution_limits": [38.710,8.920],
"number_observations": 325,
"number_observations_unique": 87,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 27.800
},
{
"type": "Completeness",
"value": 93.800
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}