Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b7be524eba5982dfcdbd498e8f40214a",
"space_group_name": "P 31",
"unit_cell": {
"a": 85.503,
"b": 85.503,
"c": 98.355,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.60500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.720,2.700],
"number_observations": 230049,
"number_observations_unique": 22053,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.131
},
{
"type": "R(meas)",
"value": 0.138
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 11.200
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 10.400
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.830,2.700],
"number_observations": 31126,
"number_observations_unique": 2965,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.740
},
{
"type": "R(meas)",
"value": 0.778
},
{
"type": "R(pim)",
"value": 0.239
},
{
"type": "I/SigI",
"value": 3.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.500
},
{
"type": "CC(1/2)",
"value": 0.761
}
]
},
{
"resolution_limits": [19.720,8.960],
"number_observations": 5826,
"number_observations_unique": 555,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 23.000
},
{
"type": "Completeness",
"value": 90.800
},
{
"type": "Redundancy",
"value": 10.500
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}