Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ae75fb86301e0d7294acc2e754f4bff9",
"space_group_name": "P 63 2 2",
"unit_cell": {
"a": 159.374,
"b": 159.374,
"c": 106.205,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [63.740,2.670],
"number_observations": 589520,
"number_observations_unique": 23127,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.318
},
{
"type": "R(meas)",
"value": 0.325
},
{
"type": "R(pim)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 8.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 25.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.800,2.670],
"number_observations": 81259,
"number_observations_unique": 3001,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.499
},
{
"type": "R(meas)",
"value": 1.529
},
{
"type": "R(pim)",
"value": 0.297
},
{
"type": "I/SigI",
"value": 3.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 27.100
},
{
"type": "CC(1/2)",
"value": 0.734
}
]
},
{
"resolution_limits": [63.740,8.860],
"number_observations": 16297,
"number_observations_unique": 738,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 15.900
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 22.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}