Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2c9916ea1054d8fff8913f3c5aac6283",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 98.735,
"b": 98.787,
"c": 128.795,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [78.37,1.94],
"number_observations": 643830,
"number_observations_unique": 46836,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.300
},
{
"type": "R(meas)",
"value": 0.311
},
{
"type": "R(pim)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 6.7
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.7
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.99,1.94],
"number_observations": 44014,
"number_observations_unique": 3069,
"quality_factors": [
{
"type": "R(merge)",
"value": 8.281
},
{
"type": "R(meas)",
"value": 8.586
},
{
"type": "R(pim)",
"value": 2.257
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Redundancy",
"value": 14.3
},
{
"type": "CC(1/2)",
"value": 0.273
}
]
}
]
}