Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8048de27e94be75457f3934b6dcfe7ad",
"space_group_name": "P 3",
"unit_cell": {
"a": 91.44,
"b": 91.44,
"c": 64.41,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97870],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.590,1.900],
"number_observations": 366913,
"number_observations_unique": 47459,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.200
},
{
"type": "R(meas)",
"value": 0.214
},
{
"type": "R(pim)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 7.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.700
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.940,1.900],
"number_observations": 23237,
"number_observations_unique": 3048,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.675
},
{
"type": "R(meas)",
"value": 1.794
},
{
"type": "R(pim)",
"value": 0.642
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.600
},
{
"type": "CC(1/2)",
"value": 0.304
}
]
},
{
"resolution_limits": [39.590,9.110],
"number_observations": 3212,
"number_observations_unique": 431,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 18.400
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 7.500
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}