Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "96bf7191890525c5b774608d61e32661",
"space_group_name": "P 41 2 2",
"unit_cell": {
"a": 102.160,
"b": 102.160,
"c": 162.714,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.87313],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [72.240,3.280],
"number_observations": 378950,
"number_observations_unique": 13867,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.282
},
{
"type": "R(meas)",
"value": 0.288
},
{
"type": "R(pim)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 11.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 27.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [3.540,3.280],
"number_observations": 74980,
"number_observations_unique": 2781,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.765
},
{
"type": "R(meas)",
"value": 1.799
},
{
"type": "R(pim)",
"value": 0.343
},
{
"type": "I/SigI",
"value": 2.500
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 27.000
},
{
"type": "CC(1/2)",
"value": 0.902
}
]
},
{
"resolution_limits": [72.240,8.670],
"number_observations": 19774,
"number_observations_unique": 865,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(meas)",
"value": 0.050
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 38.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 22.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}