Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cfe83d8efab43f17258ef690c588d014",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 37.436,
"b": 39.820,
"c": 94.384,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.87260],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.190,2.910],
"number_observations": 16032,
"number_observations_unique": 3303,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.138
},
{
"type": "R(pim)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 9.000
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 4.900
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [3.090,2.910],
"number_observations": 2156,
"number_observations_unique": 449,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.821
},
{
"type": "R(pim)",
"value": 0.403
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 82.700
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.750
}
]
},
{
"resolution_limits": [47.190,8.730],
"number_observations": 670,
"number_observations_unique": 158,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 21.600
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}