Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6116bb4a4722ab3546aa48efacd25a43",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 35.333,
"b": 50.538,
"c": 130.136,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.80000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.070,0.990],
"number_observations": 839712,
"number_observations_unique": 129938,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 28.300
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.010,0.990],
"number_observations": 39446,
"number_observations_unique": 6218,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.611
},
{
"type": "R(pim)",
"value": 0.258
},
{
"type": "I/SigI",
"value": 3.300
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.830
}
]
},
{
"resolution_limits": [65.070,5.420],
"number_observations": 5653,
"number_observations_unique": 929,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.013
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 103.900
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}