Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3c3d72d7b08741cf6ad8dfb8478079e3",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 81.720,
"b": 112.164,
"c": 62.513,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03300],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.050,1.300],
"number_observations": 915553,
"number_observations_unique": 70776,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.148
},
{
"type": "R(meas)",
"value": 0.154
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 10.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.320,1.300],
"number_observations": 43405,
"number_observations_unique": 3463,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.153
},
{
"type": "R(meas)",
"value": 3.287
},
{
"type": "R(pim)",
"value": 0.916
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.500
},
{
"type": "CC(1/2)",
"value": 0.355
}
]
},
{
"resolution_limits": [66.050,7.120],
"number_observations": 6143,
"number_observations_unique": 499,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
"value": 0.085
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 35.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}