Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "533c5474a86a5ba6e06329e7c32f30bb",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.925,
"b": 57.120,
"c": 64.893,
"alpha": 90.00,
"beta": 94.71,
"gamma": 90.00
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.24,1.51],
"number_observations": 331116,
"number_observations_unique": 49718,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.202
},
{
"type": "R(meas)",
"value": 0.220
},
{
"type": "R(pim)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 7.5
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.971
}
]
},
"refln_shells": [
{
"resolution_limits": [1.54,1.51],
"number_observations": 12911,
"number_observations_unique": 2411,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.971
},
{
"type": "R(meas)",
"value": 2.192
},
{
"type": "R(pim)",
"value": 0.940
},
{
"type": "I/SigI",
"value": 0.6
},
{
"type": "Redundancy",
"value": 5.4
},
{
"type": "CC(1/2)",
"value": 0.275
}
]
}
]
}