Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b1a642cfc7cb7168459bca47ea1f68fe",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.016,
"b": 41.612,
"c": 72.053,
"alpha": 90.000,
"beta": 103.844,
"gamma": 90.000
},
"wavelengths": [0.95373],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.61,1.35],
"number_observations_unique": 52509,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 16.2
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.37,1.35],
"number_observations_unique": 2048,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.412
},
{
"type": "R(pim)",
"value": 0.205
},
{
"type": "I/SigI",
"value": 3.6
},
{
"type": "Completeness",
"value": 78.6
},
{
"type": "CC(1/2)",
"value": 0.900
}
]
}
]
}