Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d377e499b2b2bef7790565e8af5e3723",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 45.119,
"b": 109.065,
"c": 95.017,
"alpha": 90.00,
"beta": 98.83,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.640,1.800],
"number_observations": 290996,
"number_observations_unique": 80576,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 6.600
},
{
"type": "Completeness",
"value": 96.000
},
{
"type": "Redundancy",
"value": 3.580
}
]
},
"refln_shells": [
{
"resolution_limits": [1.860,1.800],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.514
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 93.300
},
{
"type": "Redundancy",
"value": 3.540
}
]
},
{
"resolution_limits": [1.940,1.860],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.458
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 93.800
},
{
"type": "Redundancy",
"value": 3.530
}
]
},
{
"resolution_limits": [2.030,1.940],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.393
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 94.300
},
{
"type": "Redundancy",
"value": 3.510
}
]
},
{
"resolution_limits": [2.130,2.030],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.329
},
{
"type": "I/SigI",
"value": 2.700
},
{
"type": "Completeness",
"value": 94.900
},
{
"type": "Redundancy",
"value": 3.490
}
]
},
{
"resolution_limits": [2.270,2.130],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.260
},
{
"type": "I/SigI",
"value": 3.200
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 3.480
}
]
},
{
"resolution_limits": [2.440,2.270],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.204
},
{
"type": "I/SigI",
"value": 4.000
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 3.530
}
]
},
{
"resolution_limits": [2.690,2.440],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.152
},
{
"type": "I/SigI",
"value": 5.200
},
{
"type": "Completeness",
"value": 96.900
},
{
"type": "Redundancy",
"value": 3.620
}
]
},
{
"resolution_limits": [3.070,2.690],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "I/SigI",
"value": 7.800
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 3.720
}
]
},
{
"resolution_limits": [3.870,3.070],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 15.100
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 3.710
}
]
},
{
"resolution_limits": [19.640,3.870],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 19.300
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 3.700
}
]
}
]
}