Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3bb84c34b6c5aa75b3eef574071e817b",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.377,
"b": 95.377,
"c": 45.813,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.290,1.150],
"number_observations": 587882,
"number_observations_unique": 62217,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 39.200
},
{
"type": "Completeness",
"value": 85.200
},
{
"type": "Redundancy",
"value": 9.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.170,1.150],
"number_observations": 431,
"number_observations_unique": 423,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.219
},
{
"type": "R(meas)",
"value": 0.309
},
{
"type": "R(pim)",
"value": 0.219
},
{
"type": "I/SigI",
"value": 3.600
},
{
"type": "Completeness",
"value": 11.800
},
{
"type": "Redundancy",
"value": 1.000
},
{
"type": "CC(1/2)",
"value": 0.739
}
]
},
{
"resolution_limits": [41.290,6.300],
"number_observations": 5930,
"number_observations_unique": 476,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 81.100
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 12.500
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
}
]
}