Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ba76820493c5db43efd1f2c19aa896b3",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 70.571,
"b": 70.571,
"c": 197.002,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.720,2.210],
"number_observations": 670575,
"number_observations_unique": 25945,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.434
},
{
"type": "R(meas)",
"value": 0.443
},
{
"type": "R(pim)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 4.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 25.800
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.280,2.210],
"number_observations": 58384,
"number_observations_unique": 2175,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 10.987
},
{
"type": "R(pim)",
"value": 2.110
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 26.800
},
{
"type": "CC(1/2)",
"value": 0.342
}
]
},
{
"resolution_limits": [34.720,9.100],
"number_observations": 8770,
"number_observations_unique": 457,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 31.800
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 19.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}