Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "3643b2de05d791c23cd7191304876b43",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 81.94,
"b": 81.94,
"c": 134.58,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.830,2.060],
"number_observations": 652079,
"number_observations_unique": 33018,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 20.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.110,2.060],
"number_observations": 48726,
"number_observations_unique": 2386,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.731
},
{
"type": "R(meas)",
"value": 1.775
},
{
"type": "R(pim)",
"value": 0.390
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 20.400
},
{
"type": "CC(1/2)",
"value": 0.808
}
]
},
{
"resolution_limits": [48.830,9.210],
"number_observations": 6217,
"number_observations_unique": 434,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "I/SigI",
"value": 54.100
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 14.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}