Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e47edfbe092501a32d43d43dfc2fbcf1",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 77.665,
"b": 89.795,
"c": 68.854,
"alpha": 90.00,
"beta": 98.08,
"gamma": 90.00
},
"wavelengths": [0.96000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.900,1.980],
"number_observations": 488857,
"number_observations_unique": 32553,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 27.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 15.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.030,1.980],
"number_observations": 30648,
"number_observations_unique": 2232,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.286
},
{
"type": "R(pim)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 7.400
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 13.700
},
{
"type": "CC(1/2)",
"value": 0.978
}
]
},
{
"resolution_limits": [46.900,9.070],
"number_observations": 4784,
"number_observations_unique": 363,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 64.100
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 13.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}