Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b91b0fd8149ccc486dfb014844688583",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 66.20,
"b": 89.71,
"c": 100.14,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.820,1.790],
"number_observations": 268403,
"number_observations_unique": 28086,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.085
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 18.400
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 9.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.840,1.790],
"number_observations": 6562,
"number_observations_unique": 1836,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.379
},
{
"type": "R(meas)",
"value": 0.442
},
{
"type": "R(pim)",
"value": 0.219
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 89.500
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.837
}
]
},
{
"resolution_limits": [34.820,8.010],
"number_observations": 3535,
"number_observations_unique": 360,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 38.000
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 9.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}