Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "df1816df21fedc26a50cb469cb40670d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 30.702,
"b": 72.781,
"c": 55.514,
"alpha": 90.00,
"beta": 106.38,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.261,1.25],
"number_observations_unique": 31926,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 16.200
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 4.300
}
]
},
"refln_shells": [
{
"resolution_limits": [1.320,1.25],
"number_observations_unique": 4602,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.492
},
{
"type": "R(meas)",
"value": 0.606
},
{
"type": "R(pim)",
"value": 0.290
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 4.300
}
]
},
{
"resolution_limits": [1.400,1.320],
"number_observations_unique": 4374,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.339
},
{
"type": "R(meas)",
"value": 0.429
},
{
"type": "R(pim)",
"value": 0.205
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 4.300
}
]
},
{
"resolution_limits": [1.490,1.400],
"number_observations_unique": 4134,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.220
},
{
"type": "R(meas)",
"value": 0.271
},
{
"type": "R(pim)",
"value": 0.126
},
{
"type": "I/SigI",
"value": 3.100
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 4.400
}
]
},
{
"resolution_limits": [1.610,1.490],
"number_observations_unique": 3871,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "R(meas)",
"value": 0.156
},
{
"type": "R(pim)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 5.200
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 4.300
}
]
},
{
"resolution_limits": [1.770,1.610],
"number_observations_unique": 3564,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.101
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 8.200
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 4.600
}
]
},
{
"resolution_limits": [1.980,1.770],
"number_observations_unique": 3265,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 12.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 4.400
}
]
},
{
"resolution_limits": [2.280,1.980],
"number_observations_unique": 2840,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 16.500
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 4.400
}
]
},
{
"resolution_limits": [2.800,2.280],
"number_observations_unique": 2410,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 19.100
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 4.200
}
]
},
{
"resolution_limits": [3.950,2.800],
"number_observations_unique": 1845,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 19.900
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 4.200
}
]
},
{
"resolution_limits": [53.261,3.950],
"number_observations_unique": 1021,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 19.700
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 4.100
}
]
}
]
}