Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "245885efd747bf80054db2705d98b99b",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 76.372,
"b": 72.186,
"c": 139.626,
"alpha": 90.00,
"beta": 98.44,
"gamma": 90.00
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.740,2.500],
"number_observations": 706448,
"number_observations_unique": 51795,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.260
},
{
"type": "R(meas)",
"value": 0.270
},
{
"type": "R(pim)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 7.300
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 13.600
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.580,2.500],
"number_observations": 58431,
"number_observations_unique": 4444,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.508
},
{
"type": "R(meas)",
"value": 5.741
},
{
"type": "R(pim)",
"value": 1.576
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 13.100
},
{
"type": "CC(1/2)",
"value": 0.486
}
]
},
{
"resolution_limits": [39.740,10.310],
"number_observations": 11099,
"number_observations_unique": 796,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 17.300
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 13.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}