Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e7d856c94209478f432fde8c9f4a0683",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.270,
"b": 74.709,
"c": 88.722,
"alpha": 90.00,
"beta": 98.38,
"gamma": 90.00
},
"wavelengths": [0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.000,1.900],
"number_observations": 234113,
"number_observations_unique": 55831,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.117
},
{
"type": "R(meas)",
"value": 0.134
},
{
"type": "R(pim)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 9.300
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.000,1.900],
"number_observations": 33814,
"number_observations_unique": 8075,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.502
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 3.300
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 4.200
},
{
"type": "CC(1/2)",
"value": 0.838
}
]
},
{
"resolution_limits": [40.000,6.010],
"number_observations": 7539,
"number_observations_unique": 1829,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 19.000
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 4.100
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}