Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2d7b6d7c8af4ca616c1aa2811b27ebea",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 84.595,
"b": 79.177,
"c": 152.648,
"alpha": 90.00,
"beta": 93.72,
"gamma": 90.00
},
"wavelengths": [0.95374],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.680,2.500],
"number_observations": 488279,
"number_observations_unique": 69939,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.418
},
{
"type": "R(meas)",
"value": 0.452
},
{
"type": "R(pim)",
"value": 0.170
},
{
"type": "I/SigI",
"value": 4.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
"refln_shells": [
{
"resolution_limits": [2.560,2.500],
"number_observations": 30845,
"number_observations_unique": 4501,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.941
},
{
"type": "R(meas)",
"value": 4.268
},
{
"type": "R(pim)",
"value": 1.623
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.224
}
]
},
{
"resolution_limits": [34.680,11.990],
"number_observations": 4229,
"number_observations_unique": 653,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 16.900
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}