Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "00809cb437d43a0c4cd29a62096ef475",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 66.00,
"b": 89.52,
"c": 99.83,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97919],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.570,1.560],
"number_observations": 512949,
"number_observations_unique": 42389,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "R(meas)",
"value": 0.095
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 16.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.600,1.560],
"number_observations": 29562,
"number_observations_unique": 3090,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.427
},
{
"type": "R(meas)",
"value": 1.508
},
{
"type": "R(pim)",
"value": 0.483
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.600
},
{
"type": "CC(1/2)",
"value": 0.634
}
]
},
{
"resolution_limits": [29.570,6.980],
"number_observations": 5242,
"number_observations_unique": 528,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 41.400
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 9.900
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}