Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "35e520184eab7fb3b53c9a7618388665",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 57.670,
"b": 64.208,
"c": 70.500,
"alpha": 90.00,
"beta": 96.01,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,1.900],
"number_observations_unique": 38672,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 13.243
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 3.500
}
]
},
"refln_shells": [
{
"resolution_limits": [1.97,1.90],
"number_observations_unique": 2941,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.421
},
{
"type": "Completeness",
"value": 73.20
},
{
"type": "Redundancy",
"value": 2.60
}
]
},
{
"resolution_limits": [2.05,1.97],
"number_observations_unique": 3517,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.380
},
{
"type": "Completeness",
"value": 87.50
},
{
"type": "Redundancy",
"value": 3.00
}
]
},
{
"resolution_limits": [2.14,2.05],
"number_observations_unique": 3843,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.316
},
{
"type": "Completeness",
"value": 94.50
},
{
"type": "Redundancy",
"value": 3.30
}
]
},
{
"resolution_limits": [2.25,2.14],
"number_observations_unique": 3962,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.240
},
{
"type": "Completeness",
"value": 98.70
},
{
"type": "Redundancy",
"value": 3.50
}
]
},
{
"resolution_limits": [2.39,2.25],
"number_observations_unique": 4071,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.182
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 3.70
}
]
},
{
"resolution_limits": [2.58,2.39],
"number_observations_unique": 4005,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.143
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [2.84,2.58],
"number_observations_unique": 4027,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [3.25,2.84],
"number_observations_unique": 4065,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [4.09,3.25],
"number_observations_unique": 4082,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 3.80
}
]
},
{
"resolution_limits": [50.00,4.09],
"number_observations_unique": 4159,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 3.70
}
]
}
]
}