Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "602c438b3c737d652345f27010edf46a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 86.185,
"b": 66.402,
"c": 237.659,
"alpha": 90.00,
"beta": 94.34,
"gamma": 90.00
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [63.940,2.650],
"number_observations": 533127,
"number_observations_unique": 77307,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "R(meas)",
"value": 0.161
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 10.900
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.700,2.650],
"number_observations": 30649,
"number_observations_unique": 4482,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.494
},
{
"type": "R(meas)",
"value": 2.696
},
{
"type": "R(pim)",
"value": 1.013
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.360
}
]
},
{
"resolution_limits": [63.940,13.250],
"number_observations": 4471,
"number_observations_unique": 678,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 49.500
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}